TCM-ID Component

Description of the Component

Component ID	TCMH31
Latin Name	Morinda officinalis
English Name	Medicinal indianmulberry
Chinese Pinyin Name	Ba Ji Tian
中文名	巴戟天
TCM Properties
TCM Meridians
Therapeutic Class English
Therapeutic Class Chinese
Functions
Toxicity	NA
Geo-authentic habitats (道地产区)	Guangdong Province,Hong Kong,Macao
Reference	Chinese Pharmacopoeia (2015)
Barcode ID	ITSAJ4459-14
Barcode Source	BOLDSYSTEMS

TCM Prescriptions with the Component

Prescription ID	Prescription English Name	Prescription Chinese Name
TCMFx2951	An Shen Pills	安肾丸
TCMFx2955	An Yang Gu Ben Ointment	安阳固本膏
TCMFx2516	Anti-Bone Growth Drink
TCMF2979	Ba Ji Bu Shen Pills	巴戟补肾丸
TCMF3000	Ba Ji Bu Wine	巴戟补酒
TCMF2987	Ba Ji Oral Liquid	巴戟口服液
TCMFx6944	Ba Zi Bu Shen Capsules	八子补肾胶囊
TCMF3381	Bao Tai Ling	保胎灵
TCMF5993	Chang Chun Bao Oral Liquid	长春宝口服液
TCMF6001	Chang Chun Bao Pills	长春宝丸
TCMFx584	Cong Rong Yi Shen Granules	苁蓉益肾颗粒
TCMF3700	Da Hu Zhuang Yuan Pills	打虎壮元丸
TCMF1905	Decoction for Nourishing Liver	调肝汤
TCMFx1837	Decoction for Sterility	化水种子汤
TCMFx1754	Decoction for Strenthening the Spleen and Supporting the Kidney	健固汤
TCMF2560	Decoction of Rehmanniae	地黄引子
TCMF2842	Di Huang Decoction	地黄饮子
TCMF3355	Die Da Feng Shi Yao Wine	跌打风湿药酒
TCMF3759	Du Zhong Bu Tian Su Pills	杜仲补天素丸
TCMF3751	Du Zhong Bu Tian Su Tablets	杜仲补天素片
TCMF3161	Fang Shuai Yi Shou Pills	防衰益寿丸
TCMFx3731	Fo Shou Capsules	福寿胶囊
TCMF3534	Fu Fang Ge Jie Oral Liquid	复方蛤蚧口服液
TCMF537	Fu Ning Kang Tablet	妇宁康片
TCMF3021	Fu Ning Kang Tablets	妇宁康片
TCMF7079	Ge Jie Da Bu Pills	蛤蚧大补丸
TCMF4012	Ge Jie Zai Bu Pills	蛤蚧在补丸
TCMF638	Gu Ben Tong Xue Granules	固本统血颗粒
TCMF3614	Gu Ben Yan Ling Pills	固本延龄丸
TCMF3625	Gu Jing Bu Shen Pills	固精补肾丸
TCMFx4054	Gui Lu Er Jiao Pills	龟鹿二胶丸
TCMFx4075	Gui Lu Zi Shen Pills	龟鹿滋肾丸
TCMFx4107	Hai Ma Ba Ji Capsules	海马巴戟胶囊
TCMFx4121	Hai Ma Duo Bian Pills	海马多鞭丸
TCMFx4129	Hai Ma San Shen Pills	海马三肾丸
TCMF4046	Huan Shao Capsules	还少胶囊
TCMF7264	Huan Shao Dan	还少丹
TCMF4036	Huan Shao Dan	还少丹
TCMFx4240	Hui Chun Ru Yi Capsules	回春如意胶囊
TCMF6975	Huo Long Bu Shen Oral Liquid	藿龙补肾口服液
TCMF4785	Jia Wei Qing E Pills	加味青娥丸
TCMF4081	Jian Kang Bu Shen Wine	健康补肾酒
TCMFx4850	Jin Gang Tablets	金刚片
TCMF4490	Jing Shi Ling Capsules	净石灵胶囊
TCMF2298	JXT Blood Tonification Decoction	鸡血藤汤
TCMFx4191	Kang Shuai Fu Chun Tablets	抗衰复春片
TCMF2469	Kidney Tonification Decoction
TCMF2457	Life Support and Soil Care Decoction
TCMFx4763	Lu Rong Shen Bian Wine	鹿茸参鞭酒
TCMFx4823	Lu Wei Bu Shen Pills	鹿尾补肾丸
TCMF4639	Nan Bao Capsules	男宝胶囊
TCMF2529	Pellet for Impotence	赞育丹
TCMF2582	Pill for Restoring Yang	还少丹
TCMF2546	Qi and Liver Modulating Decoction	益气调肝降脂汤
TCMF5278	Quan Lu Da Bu Pills	全鹿大补丸
TCMFx5288	Quan Lu Pills	全鹿丸
TCMF464	Quan Lu Pills	全鹿丸
TCMF5466	Ren Shen Lu Rong Pills	人参鹿茸丸
TCMFx5871	San Bian Bu Wine	三鞭补酒
TCMFx5170	San Shen Pills	三肾丸
TCMFx6958	Shen Di Yi Shen Oral Liquid	参地益肾口服液
TCMFx3228	Shen Gui Zai Zao Pills	参桂再造丸
TCMF7029	Shen Lu Fu Zheng Capsules	参鹿扶正胶囊
TCMF3368	Shen Qi Er Xian Tablets	参芪二仙片
TCMFx3517	Shen Rong Bian Pills	参茸鞭丸
TCMFx3541	Shen Rong Duo Bian Wine	参茸多鞭酒
TCMF3566	Shen Rong Ge Jie Bao Shen Pills	参茸蛤蚧保肾丸
TCMFx3551	Shen Rong Gu Ben Huan Shao Pills	参茸固本还少丸
TCMFx3663	Shen Rong Pills	参茸丸
TCMF3633	Shen Rong San Qi Wine	参茸三七酒
TCMFx3679	Shen Rong Yan Ling Tablets	参茸延龄片
TCMFx5181	Suo Yang Bu Shen Capsules	锁阳补肾胶囊
TCMFx1441	Suoyang Gujing Pills	锁阳固精丸
TCMFx2621	Suoyang Gujing Pills	锁阳固精丸
TCMF5519	Tian Jing Bu Shen Ointment	添精补肾膏
TCMF1090	Tian Jing Bu Shen Ointment	添精补肾膏
TCMFx5163	Tou Gu Zhen Feng Pills	透骨镇风丸
TCMFx2754	Two-Immortal Decoction	二仙汤
TCMFx5961	Wen Shen Quan Lu Pills	温肾全鹿丸
TCMFx5313	Wu Bi Shan Yao Pills	无比山药丸
TCMFx5580	Wu Wei Zi Pills	五味子丸
TCMFx5946	Xian Rong Zhuang Yang Oral Liquid	仙茸壮阳口服液
TCMFx6753	Yang Chun Yu Oral Liquid	阳春玉液
TCMFx6701	Yi Sui Infusion	益髓冲剂
TCMF6348	Yi Zhu Tian Wine	一柱天酒
TCMF2593	Yin Nourishing Digestion Decoction	滋阴清化汤
TCMF6299	Yu Biao Bu Shen Pills	鱼鳔补肾丸
TCMFx6306	Yu Biao Pills	鱼鳔丸
TCMF6421	Yu Ye Jin Pills	玉液金丸
TCMFx6310	Zheng Gu Ointment	正骨膏
TCMFx6770	Zhi Bao San Bian Capsules	至宝三鞭胶囊
TCMFx6570	Zhuang Yao Xiao Tong Oral Liquid	壮腰消痛液
TCMF6756	Zi Shen Yu Tai Pills	滋肾育胎丸
TCMF6763	Zi Yin Bu Shen Pills	滋阴补肾丸

Targeted Human Proteins by the Ingredient of Component

Target ID	Gene Symbol	Target Name	Target Class	Uniprot ID
TCMT101	PTPN1	Protein-tyrosine phosphatase 1B	Hydrolase	P18031
TCMT158	EPHX2	Epoxide hydratase	Lyase	P34913
TCMT2	MAPT	Microtubule-associated protein tau	Unclassified	P10636
TCMT3	ALOX15	Arachidonate 15-lipoxygenase	Oxidoreductase	P16050
TCMT8	KDM4E	Lysine-specific demethylase 4D-like	Oxidoreductase	B2RXH2

Targeted Pathogenic Microbes by the Ingredient of Component

Target ID	Target Name
TCMT1464	Hepatitis B virus
TCMT1465	Entamoeba histolytica

Ingredient Structrues

Ingredient ID: TCMC6695
Formula: C15H10O4

Common Name	2-Hydroxy-3-Hydroxymethyl Anthraquinone
IUPAC Name	2-hydroxy-3-(hydroxymethyl)anthracene-9,10-dione
Canonical SMILES	OCc1cc2c(cc1O)C(=O)c1c(C2=O)cccc1
Standard InCHI	InChI=1S/C15H10O4/c16-7-8-5-11-12(6-13(8)17)15(19)10-4-2-1-3-9(10)14(11)18/h1-6,16-17H,7H2
Standard InCHIKey	LMXDYBJTJGPZPD-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL251490]; PubChem [44445519];
Reference of Component-Ingredient Pair	20966871

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC6309
Formula: C29H50O

Common Name	24-Ethylcholesterol,Beta-Sitosterol
IUPAC Name	(8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES	CC[C@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CCC(C2)O)C
Standard InCHI	InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21+,23?,24+,25-,26+,27+,28+,29-/m1/s1
Standard InCHIKey	KZJWDPNRJALLNS-VWNOLRCJSA-N
External Identifiers	ChEMBL [N/A]; PubChem [16057789];
Reference of Component-Ingredient Pair	US7090863

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH2128	Rhizoma bolbostemmae	Tu Bei Mu	土贝母

Ingredient ID: TCMC3966
Formula: C29H50O

Common Name	Sitosterol,Β-Sitosterol
IUPAC Name	(3S,8S,9S,10R,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
Canonical SMILES	CC[C@H](C(C)C)CC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)O)C
Standard InCHI	InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21+,23+,24+,25-,26+,27+,28+,29-/m1/s1
Standard InCHIKey	KZJWDPNRJALLNS-FBZNIEFRSA-N
External Identifiers	ChEMBL [CHEMBL221542]; PubChem [457801];
Reference of Component-Ingredient Pair	23115546

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH29	Croton tiglium	Ba Dou Shuang	巴豆霜
TCMH389	Gleditsiae sinensis fructus	Da Zao Jiao	大皂角
TCMH224	Thuja orientalis	Ce Bai Ye	侧柏叶
TCMH381	Isatis indigotica	Da Qing Ye	大青叶
TCMH60	Ginkgo biloba	Bai Guo	白果
TCMH287	Clematidis armandii caulis	Chuan Mu Tong	川木通
TCMH407	Salvia miltiorrhiza	Dan Shen	丹参
TCMH12	Artemisia argyi	Ai Ye	艾叶
TCMH28	Croton tiglium	Ba Dou	巴豆
TCMH305	Cnidium officinale	Chuan Xiong	川芎
TCMH240	Plantago depressa	Che Qian Cao	车前草
TCMH294	Rhizoma dioscoreae nipponicae	Chuan Shan Long	穿山龙
TCMH121	Biota orientalis	Bai Zi Ren	柏子仁
TCMH241	Plantago asiatica	Che Qian Zi	车前子
TCMH524	Eucommia ulmoides	Du Zhong	杜仲
TCMH127	Isatis indigotica	Ban Lan Gen	板蓝根
TCMH562	Saposhnikovia divaricata	Fang Feng	防风
TCMH327	Eleutherococcus senticosus	Ci Wu Jia	刺五加
TCMH104	Paeonia lactiflora	Bai Shao	白芍
TCMH130	Pinellia ternata	Ban Xia	半夏
TCMH370	Herba cirsii japonici	Da Ji(1)	大蓟
TCMH258	Paeonia obovata	Chi Shao	赤芍
TCMH430	Canavalia gladiata	Dao Dou	刀豆
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH385	Sargentodoxa cuneata	Da Xue Teng	大血藤
TCMH273	Fritillaria cirrhosa	Chuan Bei Mu	川贝母
TCMH677	Pueraria lobata	Ge Gen	葛根
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH949	Phellodendron amurense	Huang Bai	黄柏
TCMH1186	Lycium chinense	Gou Qi Zi	枸杞子
TCMH628	Glycyrrhiza uralensis	Gan Cao	甘草
TCMH700	Drynaria fortunei	Gu Sui Bu	骨碎补
TCMH776	Piper kadsura	Hai Feng Teng	海风藤
TCMH819	Polygonum multiflorum	He Shou Wu	何首乌
TCMH1127	Lonicera japonica	Jin Yin Hua	金银花
TCMH761	Cinnamomum cassia	Gui Zhi	桂枝
TCMH1376	Trachelospermum jasminoides	Luo Shi Teng	络石藤
TCMH865	Carthamus tinctorius	Hong Hua	红花
TCMH981	Astragalus membranaceus	Huang Qi	黄芪
TCMH1368	Apocyni veneti folium	Luo Bu Ma Ye	罗布麻叶
TCMH834	Semen glycine max	Hei Dou	黑豆
TCMH986	Scutellaria baicalensis	Huang Qin	黄芩
TCMH877	Radix ginseng rubra	Hong Shen	红参
TCMH1432	Vitex trifolia	Man Jing Zi	蔓荆子
TCMH1359	Pyrola calliantha	Lu Xian Cao	鹿衔草
TCMH1533	Saussurea lappa	Mu Xiang	木香
TCMH1698	Semen celosiae	Qing Xiang Zi	青葙子
TCMH1906	Cimicifuga foetida	Sheng Ma	升麻
TCMH1740	Cistanche deserticola	Rou Cong Rong	肉苁蓉
TCMH1814	Sophora subprostrata	Shan Dou Gen	山豆根
TCMH1617	Eriobotrya japonica thunb	Pi Pa Ye	枇杷叶
TCMH1953	Pyrrosia lingua	Shi Wei	石韦
TCMH1634	Typha angustata	Pu Huang	蒲黄
TCMH1665	Notopterygium incisum	Qiang Huo	羌活
TCMH1845	Dioscorea batatas	Shan Yao	山药
TCMH1768	Panax notoginseng	San Qi	三七
TCMH1680	Sinomenium acutum	Qing Feng Teng	青风藤
TCMH1531	Akebia quinata	Mu Tong	木通
TCMH1721	Panax ginseng	Ren Shen	人参
TCMH1797	Morus alba	Sang Ye	桑叶
TCMH1866	Cnidium monnieri	She Chuang Zi	蛇床子
TCMH2090	Gastrodia elata	Tian Ma	天麻
TCMH2094	Arisaema consanguineum	Tian Nan Xing	天南星
TCMH2641	Gardenia jasminoides	Zhi Zi	栀子
TCMH2545	Houttuynia cordata	Yu Xing Cao	鱼腥草
TCMH2252	Agrimonia pilosa var. japonica	Xian He Cao	仙鹤草
TCMH2722	Perilla frutescens var. arguta	Zi Su Ye	紫苏叶
TCMH2343	Scrophularia ningpoensis	Xuan Shen	玄参
TCMH2684	Ardisia crenata	Zhu Sha Gen	朱砂根
TCMH2295	fructus foeniculi	Xiao Hui Xiang	小茴香
TCMH2297	Cirsium setosum	Xiao Ji	小蓟

Ingredient ID: TCMC3946
Formula: C26H30O15

Common Name	Asperuloside Tetraacetate
IUPAC Name	[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[[(4S,7S,8S,11S)-6-(acetyloxymethyl)-2-oxo-3,9-dioxatricyclo[5.3.1.04,11]undeca-1(10),5-dien-8-yl]oxy]oxan-2-yl]methyl acetate
Canonical SMILES	CC(=O)OCC1=C[C@H]2[C@H]3[C@@H]1[C@@H]([O]=CC3=C(O2)[O-])O[C@@H]1O[C@H](COC(=O)C)[C@H]([C@@H]([C@H]1OC(=O)C)OC(=O)C)OC(=O)C
Standard InCHI	InChI=1S/C26H31O15/c1-10(27)33-7-15-6-17-20-16(24(32)39-17)8-35-25(19(15)20)41-26-23(38-14(5)31)22(37-13(4)30)21(36-12(3)29)18(40-26)9-34-11(2)28/h6,8,17-23,25-26,32H,7,9H2,1-5H3/p-1/t17-,18+,19+,20-,21+,22-,23+,25-,26-/m0/s1
Standard InCHIKey	JPVPISRZJIKXJI-GGHIHTNXSA-M
External Identifiers	ChEMBL [N/A]; PubChem [443336];
Reference of Component-Ingredient Pair	29494142

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3587
Formula: C15H10O3

Common Name	1-Hydroxy-2-Methyl-Anthraquinone
IUPAC Name	1-hydroxy-2-methylanthracene-9,10-dione
Canonical SMILES	O=C1c2ccccc2C(=O)c2c1ccc(c2O)C
Standard InCHI	InChI=1S/C15H10O3/c1-8-6-7-11-12(13(8)16)15(18)10-5-3-2-4-9(10)14(11)17/h2-7,16H,1H3
Standard InCHIKey	CZODYZFOLUNSFR-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL42302]; PubChem [160817];
Reference of Component-Ingredient Pair	19685744

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3526
Formula: C26H28O14

Common Name	Morindin
IUPAC Name	1,5-dihydroxy-2-methyl-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxymethyl]oxan-2-yl]oxyanthracene-9,10-dione
Canonical SMILES	O[C@H]1[C@@H](O[C@@H]([C@H]([C@@H]1O)O)CO[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)Oc1ccc2c(c1O)C(=O)c1c(C2=O)c(O)c(cc1)C
Standard InCHI	InChI=1S/C26H28O14/c1-8-2-3-9-14(16(8)28)17(29)10-4-5-12(20(32)15(10)18(9)30)39-26-24(36)22(34)21(33)13(40-26)7-38-25-23(35)19(31)11(27)6-37-25/h2-5,11,13,19,21-28,31-36H,6-7H2,1H3/t11-,13-,19+,21-,22+,23-,24-,25+,26-/m1/s1
Standard InCHIKey	UVLAQGRQOILFBG-UHCLWRNRSA-N
External Identifiers	ChEMBL [N/A]; PubChem [151621];
Reference of Component-Ingredient Pair	14362136

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3492
Formula: C15H10O5

Common Name	1,6-Dihydroxy-2-Methoxyanthraquinone
IUPAC Name	1,6-dihydroxy-2-methoxyanthracene-9,10-dione
Canonical SMILES	COc1ccc2c(c1O)C(=O)c1c(C2=O)cc(cc1)O
Standard InCHI	InChI=1S/C15H10O5/c1-20-11-5-4-9-12(15(11)19)14(18)8-3-2-7(16)6-10(8)13(9)17/h2-6,16,19H,1H3
Standard InCHIKey	HULRBUQQNBFVIW-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [132521];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3467
Formula: C16H12O6

Common Name	1,6-Dihydroxy-2,4-Dimethoxyanthraquinone V
IUPAC Name	1,6-dihydroxy-2,4-dimethoxyanthracene-9,10-dione
Canonical SMILES	COc1cc(OC)c(c2c1C(=O)c1cc(O)ccc1C2=O)O
Standard InCHI	InChI=1S/C16H12O6/c1-21-10-6-11(22-2)16(20)13-12(10)15(19)9-5-7(17)3-4-8(9)14(13)18/h3-6,17,20H,1-2H3
Standard InCHIKey	AZOVYGVUYZKMOP-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [126726];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3450
Formula: C15H10O4

Common Name	Rubiadin
IUPAC Name	1,3-dihydroxy-2-methylanthracene-9,10-dione
Canonical SMILES	O=C1c2ccccc2C(=O)c2c1c(O)c(c(c2)O)C
Standard InCHI	InChI=1S/C15H10O4/c1-7-11(16)6-10-12(13(7)17)15(19)9-5-3-2-4-8(9)14(10)18/h2-6,16-17H,1H3
Standard InCHIKey	IRZTUXPRIUZXMP-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL251251]; PubChem [124062];
Reference of Component-Ingredient Pair	22308688

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3355
Formula: C16H12O4

Common Name	Rubiadin-1-Methyl Ether
IUPAC Name	3-hydroxy-1-methoxy-2-methylanthracene-9,10-dione
Canonical SMILES	COc1c2C(=O)c3ccccc3C(=O)c2cc(c1C)O
Standard InCHI	InChI=1S/C16H12O4/c1-8-12(17)7-11-13(16(8)20-2)15(19)10-6-4-3-5-9(10)14(11)18/h3-7,17H,1-2H3
Standard InCHIKey	NTBUBTCXACOEEC-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL3921530]; PubChem [96191];
Reference of Component-Ingredient Pair	20966871

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3253
Formula: C16H22O11

Common Name	Monotropein
IUPAC Name	(1S,4aS,7R,7aS)-7-hydroxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylic acid
Canonical SMILES	OC[C@H]1O[C@@H](O[C@@H]2[O]=CC(=C([O-])[O-])[C@@H]3[C@H]2[C@@](O)(CO)C=C3)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C16H23O11/c17-3-8-10(19)11(20)12(21)15(26-8)27-14-9-6(1-2-16(9,24)5-18)7(4-25-14)13(22)23/h1-2,4,6,8-12,14-15,17-24H,3,5H2/p-2/t6-,8-,9-,10-,11+,12-,14+,15+,16+/m1/s1
Standard InCHIKey	OMWIHZJNNALRCH-NJPMDSMTSA-L
External Identifiers	ChEMBL [N/A]; PubChem [73466];
Reference of Component-Ingredient Pair	17913079

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC3061
Formula: C19H40

Common Name	Nonadecane
IUPAC Name	nonadecane
Canonical SMILES	CCCCCCCCCCCCCCCCCCC
Standard InCHI	InChI=1S/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3
Standard InCHIKey	LQERIDTXQFOHKA-UHFFFAOYSA-N
External Identifiers	ChEMBL [N/A]; PubChem [12401];
Reference of Component-Ingredient Pair	22573108

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH426	Codonopsis pilosula	Dang Shen	党参
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH1740	Cistanche deserticola	Rou Cong Rong	肉苁蓉
TCMH1768	Panax notoginseng	San Qi	三七

Ingredient ID: TCMC2973
Formula: C14H8O3

Common Name	Α-Hydroxyanthraquinone
IUPAC Name	1-hydroxyanthracene-9,10-dione
Canonical SMILES	Oc1cccc2c1C(=O)c1ccccc1C2=O
Standard InCHI	InChI=1S/C14H8O3/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7,15H
Standard InCHIKey	BTLXPCBPYBNQNR-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL501834]; PubChem [8512];
Reference of Component-Ingredient Pair	23684558

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Ingredient ID: TCMC2909
Formula: C15H10O2

Common Name	2-Methylanthraquinone
IUPAC Name	2-methylanthracene-9,10-dione
Canonical SMILES	Cc1ccc2c(c1)C(=O)c1c(C2=O)cccc1
Standard InCHI	InChI=1S/C15H10O2/c1-9-6-7-12-13(8-9)15(17)11-5-3-2-4-10(11)14(12)16/h2-8H,1H3
Standard InCHIKey	NJWGQARXZDRHCD-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL21745]; PubChem [6773];
Reference of Component-Ingredient Pair	19737807

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH2217	NA	Qian Cao	茜草

Ingredient ID: TCMC2883
Formula: C6H12O6

Common Name	D-Glucose,Glucose
IUPAC Name	(3R,4S,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
Canonical SMILES	OC[C@H]1OC(O)[C@@H]([C@H]([C@@H]1O)O)O
Standard InCHI	InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1
Standard InCHIKey	WQZGKKKJIJFFOK-GASJEMHNSA-N
External Identifiers	ChEMBL [CHEMBL1222250]; PubChem [5793];
Reference of Component-Ingredient Pair	22902238

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH206	Fructus xanthii sibirici	Cang Er Zi	苍耳子
TCMH90	Imperata cylindrica	Bai Mao Gen	白茅根
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH388	Ziziphus jujuba	Da Zao	大枣
TCMH1370	Siraitia grosvenorii	Luo Han Guo	罗汉果
TCMH1339	Phragmites communis	Lu Gen	芦根
TCMH1343	Aloe vera	Lu Hui	芦荟
TCMH1845	Dioscorea batatas	Shan Yao	山药
TCMH1862	Cornus officinalis	Shan Zhu Yu	山茱萸
TCMH1798	Morus alba	Sang Zhi	桑枝

Ingredient ID: TCMC1889
Formula: C16H12O5

Common Name	Physcion
IUPAC Name	1,8-dihydroxy-3-methoxy-6-methylanthracene-9,10-dione
Canonical SMILES	COc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)C
Standard InCHI	InChI=1S/C16H12O5/c1-7-3-9-13(11(17)4-7)16(20)14-10(15(9)19)5-8(21-2)6-12(14)18/h3-6,17-18H,1-2H3
Standard InCHIKey	FFWOKTFYGVYKIR-UHFFFAOYSA-N
External Identifiers	ChEMBL [CHEMBL42624]; PubChem [10639];
Reference of Component-Ingredient Pair	29667811

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH86	Ampelopsis japonica	Bai Lian	白蔹
TCMH1199	Cassia tora	Jue Ming Zi	决明子
TCMH1657	Radix moghaniae philippinensis	Qian Jin Ba	千斤拔
TCMH2631	Radix polygoni multiflori preparata	Zhi Shou Wu	制首乌
TCMH2347	Ventilago leiocarpa	Xue Feng Teng	血风藤
TCMH921	Polygonum cuspidatum	Hu Zhang	虎杖
TCMH2445	Cassia angustifolia	Yang Xie	洋泻
TCMH1589	Rumex patientia	Niu Xi Xi	牛西西
TCMH2218	Rubia cordifolia	Qian Cao Teng	茜草藤
TCMH1923	Acorus tatarinowii	Shi Chang Pu Qing Gao	石菖蒲清膏
TCMH2087	Grangea maderaspatana	Tian Ji Huang	田基黄
TCMH2505	Siphonostegia chinensis	Yin Xing Cao	阴行草
TCMH2728	Aster tataricus	Zi Wan	紫菀
TCMH2429	Bletilla striata	Yang Jiao Qi	羊角七
TCMH829	Semen pharbitidis	Hei Chou	黑丑
TCMH366	Rheum officinale	Da Huang Liu Jin Gao	大黄流浸膏
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天
TCMH819	Polygonum multiflorum	He Shou Wu	何首乌
TCMH2048	Rumex acetosa	Suan Mo	酸模
TCMH500	Benincasa hispida	Dong Gua Zi	冬瓜子
TCMH2536	Prunus japonica	Yu Li Ren	郁李仁
TCMH35	Dysosma versipellis	Ba Jiao Lian	八角莲
TCMH1965	Rheum palmatum	Shu Da Huang	熟大黄
TCMH358	Areca catechu	Da Fu Zi	大腹子
TCMH72	Bletilla striata	Bai Ji	白芨
TCMH498	Benincasa hispida	Dong Gua Pi	冬瓜皮
TCMH52	Semen pharbitidis	Bai Chou	白丑
TCMH363	Rheum officinale	Da Huang	大黄
TCMH365	Rheum officinale	Da Huang Jin Gao	大黄浸膏
TCMH557	Aster tataricus	Fan Hun Cao	返魂草
TCMH939	Aster tataricus	Huai Hun Cao	还魂草
TCMH1490	Aster tataricus	Mi Zi Wan	蜜紫菀
TCMH560	Cassia angustifolia	Fan Xie Ye	番泻叶
TCMH182	Areca catechu	Bing Lang	槟榔
TCMH1920	Acorus tatarinowii	Shi Chang Pu	石菖蒲
TCMH1922	Acorus tatarinowii	Shi Chang Pu Jin Gao	石菖蒲浸膏

Ingredient ID: TCMC1784
Formula: C23H16O5

Common Name	Ohioensin A
IUPAC Name	n.a.
Canonical SMILES	Oc1ccc2c(c1)[C@@H]1Oc3ccccc3[C@@H]3[C@H]1c1c2c(O)cc(c1C(=O)C3)O
Standard InCHI	InChI=1S/C23H16O5/c24-10-5-6-12-14(7-10)23-20-13(11-3-1-2-4-18(11)28-23)8-15(25)21-17(27)9-16(26)19(12)22(20)21/h1-7,9,13,20,23-24,26-27H,8H2/t13-,20+,23+/m1/s1
Standard InCHIKey	DBGJQYIYUBGFLT-GQIHDASDSA-N
External Identifiers	ChEMBL [CHEMBL403093]; PubChem [442531];
Reference of Component-Ingredient Pair	N/A

Occurrence of the ingredient across TCM components

Component ID	Latin Name	Pinyin Name	Chinese Name
TCMH31	Morinda officinalis	Ba Ji Tian	巴戟天

Properties

Ingredient ID	Formulae	Name	MW	AlogP	MlogP	XlogP	# HBA	# HBD	PSA	# Rotatable Bond	# Ring	# Heacy Atom	Lipinski RO5 Violation
TCMC1784	C23H16O5	Ohioensin A	372.1	-1.883	3.44	2.494	1	3	86.99	3	6	28	0
TCMC1889	C16H12O5	Physcion	284.07	-0.858	2.67	1.183	2	2	83.83	5	3	21	0
TCMC2883	C6H12O6	D-Glucose,Glucose	180.0633881	-2.5134	1.46	-1.697	6	5	110.38	1	1	12	0
TCMC2909	C15H10O2	2-Methylanthraquinone	222.0680796	0.1144	2.89	4.397	2	0	34.14	0	3	17	0
TCMC2973	C14H8O3	Α-Hydroxyanthraquinone	224.0473441	-0.9879	2.67	2.689	2	1	54.37	0	3	17	0
TCMC3061	C19H40	Nonadecane	268.3130013	-4.7934	3.55	11.151	0	0	0	16	0	19	2
TCMC3253	C16H22O11	Monotropein	389.1083865	-4.7139	2.01	-2.675	11	6	185.96	4	3	27	2
TCMC3355	C16H12O4	Rubiadin-1-Methyl Ether	268.0735589	-0.3977	2.78	2.357	2	1	63.6	1	3	20	0
TCMC3450	C15H10O4	Rubiadin	254.0579088	-0.8062	2.67	1.838	2	2	74.6	0	3	19	0
TCMC3467	C16H12O6	1,6-Dihydroxy-2,4-Dimethoxyanthraquinone V	300.0633881	-1.5518	2.56	0.416	2	2	93.06	2	3	22	0
TCMC3492	C15H10O5	1,6-Dihydroxy-2-Methoxyanthraquinone	270.0528234	-1.5	2.56	0.86	2	2	83.83	1	3	20	0
TCMC3526	C26H28O14	Morindin	564.1479056	-4.2496	2.78	-1.949	11	8	232.9	5	5	40	2
TCMC3587	C15H10O3	1-Hydroxy-2-Methyl-Anthraquinone	238.0629942	-0.3459	2.78	2.801	2	1	54.37	0	3	18	0
TCMC3946	C26H30O15	Asperuloside Tetraacetate	582.1584703	-1.5826	2.67	0.28	15	0	182.25	14	4	41	2
TCMC3966	C29H50O	Sitosterol,Β-Sitosterol	414.3861662	1.3	4.54	11.595	1	1	20.23	6	4	30	1
TCMC6309	C29H50O	24-Ethylcholesterol,Beta-Sitosterol	414.3861662	1.3	4.54	11.595	1	1	20.23	6	4	30	1
TCMC6695	C15H10O4	2-Hydroxy-3-Hydroxymethyl Anthraquinone	254.0579088	-1.4366	2.67	2.098	3	2	74.6	1	3	19	0

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Data Section	Select to Download
1. General Information of the Component
2. TCM Prescriptions with the Component
3. Putative Targets
4. Activity & References for Filtering Putative Targets
5. Ingredient Data & Chemical Structure Information (Properties, InChI, InChIkey, SMILES, etc.)

Component: Morinda officinalis 巴戟天

Description of the Component

Component ID

Latin Name

English Name

Chinese Pinyin Name

中文名

TCM Properties

TCM Meridians

Therapeutic Class English

Therapeutic Class Chinese

Functions

Toxicity

Geo-authentic habitats (道地产区)

Reference

Barcode ID

Barcode Source

TCM Prescriptions with the Component

Targeted Human Proteins by the Ingredient of Component

Targeted Pathogenic Microbes by the Ingredient of Component

Ingredient Structrues

Ingredient ID: TCMC6695

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC6309

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3966

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3946

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3587

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3526

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3492

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3467

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3450

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3355

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3253

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC3061

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2973

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2909

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC2883

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1889

Occurrence of the ingredient across TCM components

Ingredient ID: TCMC1784

Occurrence of the ingredient across TCM components

Properties

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