NPASS Natural Product

Natural Product: NPC117572

Natural Product ID:	NPC117572
Common Name:	Icosapent
IUPAC Name:	(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoic acid
Synonyms:	eicosapentaenoic acid; Icosapent; Omega-3 marine triglycerides
Molecular Formula:	C20H30O2
Standard InCHIKey:	JAZBEHYOTPTENJ-JLNKQSITSA-N
Standard InCHI:	InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,13-12-,16-15-
Canonical SMILES:	CC/C=CC/C=CC/C=CC/C=CC/C=CCCCC(=O)O
First Find Year:
Max Developmental Stage:
Synthetic Gene Cluster:	BGC0000861;BGC0000862;BGC0000863;BGC0000865 ;

Species Source

Organism ID	Organism Name	Taxonomy Level	Family	SuperKingdom	Isolation Part	Collection Location	Collection Time	Reference
NPO21324	Plantago major	Species	Plantaginaceae	Eukaryota	Whole Plant	the surroundings of Uppsala, Sweden	1998-SEP	PMID[11421736]
NPO21324	Plantago major	Species	Plantaginaceae	Eukaryota	Entire plants	the surroundings of Uppsala, Sweden	1998-SEP	PMID[11421736]
NPO20338	Mus musculus	Species	Muridae	Eukaryota				PMID[25518943]
NPO30323	Daphnia galeata	Species	Daphniidae	Eukaryota				Freshwater Biology,1997,38:731-738
NPO4573	Mortierella alpina	Species	Mortierellaceae	Eukaryota				PMID[9668087]
NPO19467	Aeglopsis chevalieri	Species	Rutaceae	Eukaryota				UNPD*
NPO8860	Hippospongia equina	Species	Spongiidae	Eukaryota				UNPD*
NPO21060	Hydnocarpus annamensis	Species	Achariaceae	Eukaryota				UNPD*
NPO29577	Arecae semen	NA	NA	NA				TCMSP*
NPO22715	Alpinia oxyphylla	Species	Zingiberaceae	Eukaryota				TM-MC*
NPO25443	Citrus reticulata	Species	Rutaceae	Eukaryota				TM-MC*
NPO10082	Citrus unshiu	Species	Rutaceae	Eukaryota				TM-MC*
NPO21275	Phoenix paludosa	Species	Arecaceae	Eukaryota				UNPD*
NPO1797	Homo sapiens	Species	Hominidae	Eukaryota	blood			PMID[20671299]

Biological Activity

Activity Type	# Activity
EC50	2
IC50	12
Kd	1
LD50	1
Others	3
Potency	16

Activity Type	# Activity
Cell Line	3
Individual Protein	24
Organism	1
Others	7

Target ID	Target Type	Target Name	Target Organism	Activity Type	Activity Relation	Value	Unit	Reference
NPT191	Organism	Hepatitis C virus	Hepatitis C virus	EC50	=	36200	nM	17420205
NPT2	Others	Unspecified		Ratio IC50	=	0.5		11421736
NPT325	Individual Protein	Cyclooxygenase-2	Ovis aries	IC50	=	7100	nM	11421736
NPT1665	Individual Protein	Cyclooxygenase-1	Bos taurus	IC50	=	13000	nM	11421736
NPT677	Individual Protein	Coagulation factor III	Homo sapiens	IC50	=	78000	nM	9834151
NPT863	Individual Protein	Trypsin	Sus scrofa	IC50	>	200000	nM	9834151
NPT2	Others	Unspecified		IC50	=	300	nM	18459759
NPT441	Individual Protein	Cytochrome P450 19A1	Homo sapiens	Activity	=	30.2	%	16643058
NPT441	Individual Protein	Cytochrome P450 19A1	Homo sapiens	IC50	=	53200	nM	16643058
NPT441	Individual Protein	Cytochrome P450 19A1	Homo sapiens	Activity	=	137.6	%	16643058
NPT1038	Individual Protein	Histone-lysine N-methyltransferase MLL	Homo sapiens	Potency	=	50118.7	nM	PubChem BioAssay data set
NPT94	Individual Protein	Aldehyde dehydrogenase 1A1	Homo sapiens	Potency	=	39810.7	nM	PubChem BioAssay data set
NPT53	Individual Protein	4'-phosphopantetheinyl transferase ffp	Bacillus subtilis	Potency	=	70794.6	nM	PubChem BioAssay data set
NPT53	Individual Protein	4'-phosphopantetheinyl transferase ffp	Bacillus subtilis	Potency	=	89125.1	nM	PubChem BioAssay data set
NPT5	Individual Protein	Histone-lysine N-methyltransferase, H3 lysine-9 specific 3	Homo sapiens	Potency		5011.9	nM	PubChem BioAssay data set
NPT198	Individual Protein	Vitamin D receptor	Homo sapiens	Potency		39810.7	nM	PubChem BioAssay data set
NPT698	Individual Protein	Regulator of G-protein signaling 4	Homo sapiens	Potency		8436.8	nM	PubChem BioAssay data set
NPT199	Individual Protein	DNA polymerase kappa	Homo sapiens	Potency		11220.2	nM	PubChem BioAssay data set
NPT444	Individual Protein	Ubiquitin carboxyl-terminal hydrolase 1	Homo sapiens	Potency		79432.8	nM	PubChem BioAssay data set
NPT113	Cell Line	RAW264.7	Mus musculus	LD50	>	0.01	nM	21903399
NPT99	Individual Protein	Peroxisome proliferator-activated receptor gamma	Homo sapiens	Kd	=	2000	nM	22260081
NPT100	Individual Protein	Glutaminase kidney isoform, mitochondrial	Homo sapiens	Potency		31622.8	nM	PubChem BioAssay data set
NPT784	Cell Line	MDA-MB-468	Homo sapiens	EC50	>	100000	nM	22822908
NPT784	Cell Line	MDA-MB-468	Homo sapiens	IC50	>	100000	nM	22822908
NPT866	Individual Protein	Peroxisome proliferator-activated receptor alpha	Homo sapiens	IC50	=	1100	nM	10.1007/s00044-008-9102-7
NPT106	Individual Protein	Peroxisome proliferator-activated receptor delta	Homo sapiens	IC50	=	4000	nM	10.1007/s00044-012-0285-6
NPT99	Individual Protein	Peroxisome proliferator-activated receptor gamma	Homo sapiens	IC50	=	1600	nM	10.1007/s00044-012-0285-6
NPT866	Individual Protein	Peroxisome proliferator-activated receptor alpha	Homo sapiens	IC50	=	1100	nM	10.1007/s00044-012-0285-6
NPT2	Others	Unspecified		Potency		23715	nM	PubChem BioAssay data set
NPT2	Others	Unspecified		Potency		33498.3	nM	PubChem BioAssay data set
NPT4030	Individual Protein	Oxoeicosanoid receptor 1	Homo sapiens	IC50	=	2000	nM	24351031
NPT153	Individual Protein	Androgen Receptor	Homo sapiens	Potency		26832.5	nM	PubChem BioAssay data set
NPT2	Others	Unspecified		Potency		33491.5	nM	PubChem BioAssay data set
NPT2	Others	Unspecified		Potency		10682.2	nM	PubChem BioAssay data set

Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

● The left chart: Distribution of similarity level between NPC117572 and all remaining natural products in the NPASS database.
● The right table: Most similar natural products (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	43
0.1-0.2	2367
0.2-0.3	13761
0.3-0.4	8291
0.4-0.5	4685
0.5-0.6	1358
0.6-0.7	258
0.7-0.8	84
0.8-0.85	25
0.85-0.9	11
0.9-0.95	5
0.95-1	1

Similarity Score	Similarity Level	Natural Product ID
0.9545	High Similarity	NPC91495
0.9333	High Similarity	NPC149821
0.9333	High Similarity	NPC5413
0.913	High Similarity	NPC59051
0.9111	High Similarity	NPC207292
0.907	High Similarity	NPC270796
0.8936	High Similarity	NPC48162
0.8889	High Similarity	NPC42304
0.875	High Similarity	NPC92114
0.8571	High Similarity	NPC36061
0.8571	High Similarity	NPC294548
0.8571	High Similarity	NPC1813
0.8571	High Similarity	NPC321062
0.8571	High Similarity	NPC70387
0.8571	High Similarity	NPC139029
0.8542	High Similarity	NPC284212
0.8542	High Similarity	NPC28205
0.84	Intermediate Similarity	NPC87564
0.84	Intermediate Similarity	NPC85813
0.84	Intermediate Similarity	NPC25417
0.84	Intermediate Similarity	NPC6095
0.84	Intermediate Similarity	NPC88966
0.84	Intermediate Similarity	NPC322461
0.84	Intermediate Similarity	NPC281972
0.84	Intermediate Similarity	NPC424
0.84	Intermediate Similarity	NPC32467
0.84	Intermediate Similarity	NPC154245
0.84	Intermediate Similarity	NPC290563
0.84	Intermediate Similarity	NPC261831
0.8367	Intermediate Similarity	NPC281245
0.8367	Intermediate Similarity	NPC129458
0.8367	Intermediate Similarity	NPC303765
0.8235	Intermediate Similarity	NPC473863
0.8235	Intermediate Similarity	NPC274290
0.82	Intermediate Similarity	NPC10081
0.82	Intermediate Similarity	NPC225066
0.8077	Intermediate Similarity	NPC327388
0.8077	Intermediate Similarity	NPC187777
0.8077	Intermediate Similarity	NPC325977
0.8077	Intermediate Similarity	NPC18951
0.8077	Intermediate Similarity	NPC477201
0.8077	Intermediate Similarity	NPC179764
0.7959	Intermediate Similarity	NPC224227
0.7925	Intermediate Similarity	NPC225929
0.7925	Intermediate Similarity	NPC323597
0.7925	Intermediate Similarity	NPC323436
0.7925	Intermediate Similarity	NPC211752
0.7925	Intermediate Similarity	NPC323498
0.7885	Intermediate Similarity	NPC45626
0.7885	Intermediate Similarity	NPC54766
0.78	Intermediate Similarity	NPC178586
0.78	Intermediate Similarity	NPC262968
0.7778	Intermediate Similarity	NPC329819
0.7692	Intermediate Similarity	NPC137538
0.7647	Intermediate Similarity	NPC477779
0.7636	Intermediate Similarity	NPC329249
0.7636	Intermediate Similarity	NPC329550
0.7636	Intermediate Similarity	NPC106851
0.7636	Intermediate Similarity	NPC274927
0.7636	Intermediate Similarity	NPC322002
0.7551	Intermediate Similarity	NPC180534
0.7547	Intermediate Similarity	NPC67367
0.7547	Intermediate Similarity	NPC52264
0.75	Intermediate Similarity	NPC251042
0.75	Intermediate Similarity	NPC122521
0.75	Intermediate Similarity	NPC328311
0.75	Intermediate Similarity	NPC139545
0.75	Intermediate Similarity	NPC243532
0.75	Intermediate Similarity	NPC309606
0.75	Intermediate Similarity	NPC174447
0.75	Intermediate Similarity	NPC327112
0.75	Intermediate Similarity	NPC81896
0.75	Intermediate Similarity	NPC321919
0.75	Intermediate Similarity	NPC235242
0.75	Intermediate Similarity	NPC39633
0.7455	Intermediate Similarity	NPC267817
0.7451	Intermediate Similarity	NPC477777
0.74	Intermediate Similarity	NPC163345
0.7368	Intermediate Similarity	NPC201939
0.7368	Intermediate Similarity	NPC321838
0.7368	Intermediate Similarity	NPC320305
0.7368	Intermediate Similarity	NPC40082
0.7368	Intermediate Similarity	NPC328776
0.7308	Intermediate Similarity	NPC18357
0.7241	Intermediate Similarity	NPC322457
0.7222	Intermediate Similarity	NPC223677
0.7222	Intermediate Similarity	NPC477984
0.7222	Intermediate Similarity	NPC474672
0.7222	Intermediate Similarity	NPC200845
0.7222	Intermediate Similarity	NPC228473
0.7222	Intermediate Similarity	NPC128061
0.7222	Intermediate Similarity	NPC28779
0.7222	Intermediate Similarity	NPC10316
0.717	Intermediate Similarity	NPC71761
0.7143	Intermediate Similarity	NPC34416
0.7119	Intermediate Similarity	NPC328089
0.7119	Intermediate Similarity	NPC470320
0.7119	Intermediate Similarity	NPC68343
0.7115	Intermediate Similarity	NPC470410
0.7115	Intermediate Similarity	NPC470412
0.7111	Intermediate Similarity	NPC34873
0.7111	Intermediate Similarity	NPC155880
0.7111	Intermediate Similarity	NPC40434
0.7111	Intermediate Similarity	NPC92863
0.7069	Intermediate Similarity	NPC174560
0.7069	Intermediate Similarity	NPC125312
0.7069	Intermediate Similarity	NPC113293
0.7059	Intermediate Similarity	NPC207815
0.7037	Intermediate Similarity	NPC474127
0.7037	Intermediate Similarity	NPC87394
0.7018	Intermediate Similarity	NPC322186
0.7018	Intermediate Similarity	NPC318306
0.7	Intermediate Similarity	NPC255863
0.7	Intermediate Similarity	NPC326268
0.7	Intermediate Similarity	NPC478098
0.7	Intermediate Similarity	NPC478099
0.7	Intermediate Similarity	NPC476657
0.7	Intermediate Similarity	NPC308331
0.7	Intermediate Similarity	NPC318420
0.7	Intermediate Similarity	NPC136164
0.7	Intermediate Similarity	NPC317881
0.7	Intermediate Similarity	NPC245947
0.7	Intermediate Similarity	NPC476654
0.7	Intermediate Similarity	NPC320642
0.7	Intermediate Similarity	NPC476655
0.7	Intermediate Similarity	NPC323045
0.6981	Remote Similarity	NPC216407
0.6949	Remote Similarity	NPC68110
0.6939	Remote Similarity	NPC6963
0.6939	Remote Similarity	NPC304079
0.6923	Remote Similarity	NPC225974
0.6885	Remote Similarity	NPC478101
0.6885	Remote Similarity	NPC476659
0.6885	Remote Similarity	NPC476656
0.6863	Remote Similarity	NPC216130
0.6852	Remote Similarity	NPC284224
0.6852	Remote Similarity	NPC217188
0.6842	Remote Similarity	NPC325734
0.6842	Remote Similarity	NPC478096
0.6833	Remote Similarity	NPC226592
0.6809	Remote Similarity	NPC123357
0.6792	Remote Similarity	NPC15129
0.6792	Remote Similarity	NPC477458
0.6792	Remote Similarity	NPC470411
0.6792	Remote Similarity	NPC43053
0.6786	Remote Similarity	NPC472808
0.6786	Remote Similarity	NPC324224
0.678	Remote Similarity	NPC477829
0.6774	Remote Similarity	NPC22101
0.6774	Remote Similarity	NPC478100
0.6774	Remote Similarity	NPC330426
0.6774	Remote Similarity	NPC478097
0.6774	Remote Similarity	NPC127091
0.6774	Remote Similarity	NPC271921
0.6774	Remote Similarity	NPC99619
0.6774	Remote Similarity	NPC49863
0.6774	Remote Similarity	NPC104537
0.6774	Remote Similarity	NPC148192
0.6774	Remote Similarity	NPC26500
0.6739	Remote Similarity	NPC180840
0.6731	Remote Similarity	NPC135698
0.6731	Remote Similarity	NPC267110
0.6727	Remote Similarity	NPC300121
0.6724	Remote Similarity	NPC478095
0.6721	Remote Similarity	NPC323477
0.6667	Remote Similarity	NPC283502
0.6667	Remote Similarity	NPC170167
0.6667	Remote Similarity	NPC472445
0.6667	Remote Similarity	NPC324981
0.6667	Remote Similarity	NPC161366
0.6667	Remote Similarity	NPC477776
0.6667	Remote Similarity	NPC151919
0.6667	Remote Similarity	NPC473559
0.6667	Remote Similarity	NPC273508
0.6667	Remote Similarity	NPC48218
0.6667	Remote Similarity	NPC221250
0.6667	Remote Similarity	NPC87137
0.6667	Remote Similarity	NPC476614
0.6667	Remote Similarity	NPC209327
0.6667	Remote Similarity	NPC141481
0.6613	Remote Similarity	NPC142423
0.6613	Remote Similarity	NPC308294
0.6613	Remote Similarity	NPC328653
0.661	Remote Similarity	NPC143857
0.661	Remote Similarity	NPC229252
0.6604	Remote Similarity	NPC27264
0.6562	Remote Similarity	NPC317583
0.6562	Remote Similarity	NPC143396
0.6562	Remote Similarity	NPC236208
0.6557	Remote Similarity	NPC476658
0.6557	Remote Similarity	NPC234767
0.6552	Remote Similarity	NPC469373
0.6552	Remote Similarity	NPC254095
0.6552	Remote Similarity	NPC471619
0.6531	Remote Similarity	NPC187922
0.6522	Remote Similarity	NPC158179
0.6522	Remote Similarity	NPC185839
0.6508	Remote Similarity	NPC475443
0.6508	Remote Similarity	NPC25298
0.6508	Remote Similarity	NPC60120

Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

● The left chart: Distribution of similarity level between NPC117572 and all drugs/candidates.
● The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

range	Tanimoto Coefficient
0-0.1	51
0.1-0.2	2994
0.2-0.3	4325
0.3-0.4	1279
0.4-0.5	416
0.5-0.6	69
0.6-0.7	7
0.7-0.8	9
0.8-0.85	5
0.85-0.9	2
0.9-0.95	3
0.95-1	1

Similarity Score	Similarity Level	Drug ID	Developmental Stage
1.0	High Similarity	NPD4222	Approved
0.9333	High Similarity	NPD3173	Approved
0.9091	High Similarity	NPD39	Approved
0.907	High Similarity	NPD5326	Phase 3
0.8667	High Similarity	NPD3174	Discontinued
0.8571	High Similarity	NPD3172	Approved
0.84	Intermediate Similarity	NPD4266	Approved
0.84	Intermediate Similarity	NPD3195	Phase 2
0.84	Intermediate Similarity	NPD3194	Approved
0.84	Intermediate Similarity	NPD3196	Approved
0.8298	Intermediate Similarity	NPD5343	Approved
0.78	Intermediate Similarity	NPD28	Approved
0.78	Intermediate Similarity	NPD29	Approved
0.766	Intermediate Similarity	NPD6096	Approved
0.766	Intermediate Similarity	NPD6097	Approved
0.7551	Intermediate Similarity	NPD622	Approved
0.75	Intermediate Similarity	NPD4246	Clinical (unspecified phase)
0.7455	Intermediate Similarity	NPD6109	Phase 1
0.7119	Intermediate Similarity	NPD3197	Phase 1
0.7059	Intermediate Similarity	NPD4220	Pre-registration
0.6792	Remote Similarity	NPD6927	Phase 3
0.6774	Remote Similarity	NPD4247	Clinical (unspecified phase)
0.6596	Remote Similarity	NPD5783	Phase 3
0.6471	Remote Similarity	NPD4265	Approved
0.64	Remote Similarity	NPD9411	Phase 1
0.614	Remote Similarity	NPD8971	Approved
0.6	Remote Similarity	NPD2270	Approved
0.5918	Remote Similarity	NPD9450	Approved
0.5918	Remote Similarity	NPD633	Phase 3
0.5918	Remote Similarity	NPD9448	Phase 2
0.5918	Remote Similarity	NPD77	Approved
0.5873	Remote Similarity	NPD2664	Clinical (unspecified phase)
0.587	Remote Similarity	NPD8857	Approved
0.5846	Remote Similarity	NPD7331	Phase 2
0.5833	Remote Similarity	NPD5784	Clinical (unspecified phase)
0.5833	Remote Similarity	NPD3732	Approved
0.5833	Remote Similarity	NPD4268	Approved
0.5833	Remote Similarity	NPD4271	Approved
0.5714	Remote Similarity	NPD4191	Approved
0.5714	Remote Similarity	NPD4194	Approved
0.5714	Remote Similarity	NPD4192	Approved
0.5714	Remote Similarity	NPD4193	Approved
0.5694	Remote Similarity	NPD4756	Discovery
0.5676	Remote Similarity	NPD4252	Approved
0.5676	Remote Similarity	NPD4819	Approved
0.5676	Remote Similarity	NPD5368	Approved
0.5676	Remote Similarity	NPD5790	Clinical (unspecified phase)
0.5676	Remote Similarity	NPD4821	Approved
0.5676	Remote Similarity	NPD4820	Approved
0.5676	Remote Similarity	NPD4822	Approved
0.566	Remote Similarity	NPD3199	Clinical (unspecified phase)
0.56	Remote Similarity	NPD5369	Approved
0.56	Remote Similarity	NPD9655	Approved

Structure

CID117572 OpenBabel06191715472D 22 21 0 0 0 0 0 0 0 0999 V2000 3.4641 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9282 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0622 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3301 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4641 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M END $$$$

External Identifiers

PubChem CID	446284
ChEMBL	CHEMBL460026
ZINC

Physicochemical Properties

Molecular Weight:	302.22
ALogP:	2.1145
MLogP:	3.44
XLogP:	8.022
# Rotatable Bonds:	15
Polar Surface Area:	37.3
# H-Bond Aceptor:	2
# H-Bond Donor:	1
# Rings:	0
# Heavy Atoms:	22

Download Data

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General Info & Identifiers & Properties
Structure MOL file
Source Organisms
Biological Activities
Similar NPs/Drugs