NPC291607 |
UGPRSKLZICXSBQ-GFQBYJJVSA-N |
n.a. |
0 |
0 |
NPC239173 |
XUFJWSCTCKJHTJ-ZYDLEXOLSA-N |
n.a. |
0 |
0 |
NPC229378 |
QIPITLICOVJMDG-KCFNGDSUSA-N |
n.a. |
0 |
0 |
NPC12947 |
SCIUCADXFKAPEB-INIZCTEOSA-N |
n.a. |
0 |
0 |
NPC470834 |
Sipholenone A |
(5aR,6R,7S,9aR)-7-hydroxy-6-[2-[(1R)-1-hydroxy-1,4,4,6-tetramethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one |
6 |
10 |
NPC72804 |
YBPWTJKOAKCPCG-DREBAJGFSA-N |
n.a. |
0 |
0 |
NPC29048 |
JOEDNPJQLDSURA-YFQPMUSFSA-N |
n.a. |
0 |
0 |
NPC152317 |
BQSAGDWOHVQNFB-GOSISDBHSA-N |
n.a. |
0 |
0 |
NPC473258 |
28-Hydroxysipholenol A |
(3R,5aR,6R,7S,9aR)-6-[2-[(1R)-1-hydroxy-6-(hydroxymethyl)-1,4,4-trimethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
4 |
6 |
NPC299870 |
BGLPWKQUOIXBNP-CTNBYYEDSA-N |
n.a. |
0 |
0 |
NPC153063 |
CIASNNVTZABFTB-BSWVEEBUSA-N |
n.a. |
0 |
0 |
NPC121466 |
HFWXFODSEPKDFR-UHFFFAOYSA-N |
n.a. |
0 |
0 |
NPC146116 |
QYKGFAFEQMXHRJ-BCCWFXHYSA-N |
n.a. |
0 |
0 |
NPC70380 |
(R)-De-O-Methyllasioplodin |
(9R)-13,15-dihydroxy-9-methyl-10-oxabicyclo[10.4.0]hexadeca-1(12),13,15-trien-11-one |
2 |
4 |
NPC83662 |
VKWZFIDWHLCPHJ-ZRTHHSRSSA-M |
n.a. |
0 |
0 |
NPC115607 |
Siphonellinol C |
(3R,5aR,6R,7S,9aR)-6-[2-[(5R,6S)-5-hydroxy-6-[(E)-4-hydroxy-4-methylpent-2-enyl]-2,6-dimethylcyclohexen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
4 |
6 |
NPC94314 |
KBZJWPGSJWUHPT-FJUGQGNPSA-N |
n.a. |
0 |
0 |
NPC470832 |
Sipholenol A |
(3R,5aR,6R,7S,9aR)-6-[2-[(1R)-1-hydroxy-1,4,4,6-tetramethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
7 |
12 |
NPC200620 |
TYGYPIIOOQNWBU-BTRLNGJCSA-N |
n.a. |
0 |
0 |
NPC7694 |
OHRCEQTZXISPOL-LJQANCHMSA-N |
n.a. |
0 |
0 |
NPC272451 |
Sipholenol J |
(3S,4Z,4aR,8S,8aS)-4-[2-[(3S,5aS,6S,7S,9aS)-3,7-dihydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethylidene]-8-hydroxy-3,5,5,8-tetramethyl-4a,6,7,8a-tetrahydro-1H-naphthalen-2-one |
1 |
2 |
NPC63959 |
PIGLOISSVVAGBD-NHQGMKOOSA-N |
n.a. |
0 |
0 |
NPC190070 |
VUUWEVURXOCTGG-BYCLXTJYSA-N |
n.a. |
1 |
1 |
NPC123143 |
IJURZYNOTGJREA-RDUIAEDZSA-N |
n.a. |
0 |
0 |
NPC187311 |
AJGBRMOBLUVLIU-KSWFMABOSA-N |
n.a. |
0 |
0 |
NPC189777 |
Sipholenol L |
(3S,5aS,6S,7S,9aS)-6-[2-[(1S,4aS,5S,8aR)-5-hydroxy-2,5,8,8-tetramethyl-1,4,4a,6,7,8a-hexahydronaphthalen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
1 |
2 |
NPC266082 |
VKWZFIDWHLCPHJ-SEVDZJIVSA-L |
n.a. |
0 |
0 |
NPC470839 |
(1R,E)-1-Hydroxy-5-(2-((5Ar,6R,7S,9Ar)-7-Hydroxy-2,2,5A,7-Tetramethyl-3-Oxo-Decahydrobenzo[B]Oxepin-6-Yl)Ethyl)-1,4,4-Trimethyl-1,2,3,3A,4,5,8,8A-Octahydroazulene-6-Carbaldehyde |
(3R)-7-[2-[(5aR,6R,7S,9aR)-7-hydroxy-2,2,5a,7-tetramethyl-3-oxo-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-6-yl]ethyl]-3-hydroxy-3,8,8-trimethyl-1,2,3a,4,7,8a-hexahydroazulene-6-carbaldehyde |
4 |
6 |
NPC283004 |
OWDVCSOUUJWXSS-LASZZGENSA-N |
n.a. |
0 |
0 |
NPC164770 |
IOHDZHGPFHNSQP-DREBAJGFSA-N |
n.a. |
0 |
0 |
NPC16468 |
CZCOTALTGQFFGO-QUVTWCLGSA-N |
n.a. |
0 |
0 |
NPC25597 |
BQSAGDWOHVQNFB-SFHVURJKSA-N |
n.a. |
0 |
0 |
NPC188539 |
AROFVSZVAKNDAP-XGICHPGQSA-N |
n.a. |
0 |
0 |
NPC42262 |
Isovaleryl Alkannin |
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-methylbutanoate |
6 |
18 |
NPC92471 |
BSXTWYDVYNXVHH-YKNDAMCPSA-N |
n.a. |
0 |
0 |
NPC220496 |
(S)-Alpha-Methylbutyryl Alkannin |
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] (2S)-2-methylbutanoate |
6 |
18 |
NPC313004 |
PBTJWDSMUBVOKC-ZRDIBKRKSA-N |
n.a. |
0 |
0 |
NPC281517 |
LMNZEDXMWAJKBB-SJCQXOIGSA-N |
n.a. |
0 |
0 |
NPC136758 |
ZCEYOMXMDDYIQP-WGKOQXAXSA-N |
n.a. |
0 |
0 |
NPC473257 |
Sipholenol I |
(1aS,5R,7R,7aR)-1a-[2-[(3R,5aR,6R,7S,9aR)-3,7-dihydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethyl]-2,2,5,7a-tetramethyl-2a,3,4,5a,6,7-hexahydroazuleno[5,6-b]oxirene-5,7-diol |
4 |
6 |
NPC293086 |
(5As,6S,7S,9As)-7-Hydroxy-6-((E)-2-((2R,4As,5S,8Ar)-5-Hydroxy-2,5,8,8-Tetramethyloctahydronaphthalen-1(2H)-Ylidene)-Ethyl)-2,2,5A,7-Tetramethyloctahydrobenzo(B)Oxepin-3(2H)-One |
(5aS,6S,7S,9aS)-6-[(2E)-2-[(2R,4aS,5S,8aR)-5-hydroxy-2,5,8,8-tetramethyl-3,4,4a,6,7,8a-hexahydro-2H-naphthalen-1-ylidene]ethyl]-7-hydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one |
1 |
2 |
NPC290731 |
Siphonellinol D |
(3S,5aS,6S,7R,9aS)-6-[2-[(5R,6S)-5-hydroxy-2,6-dimethyl-6-(4-methylpent-3-enyl)cyclohexen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
3 |
6 |
NPC108400 |
OXNJGMNJOVOFOW-ZMZPIMSZSA-N |
n.a. |
0 |
0 |
NPC5555 |
VSXJBZJIZDSPFF-JGQRDLFRSA-N |
n.a. |
0 |
0 |
NPC59196 |
UVFOCYGYACXLAY-ZDQUCUCBSA-N |
n.a. |
0 |
0 |
NPC233744 |
Sipholenol M |
(3S,5aS,6S,7S,9aS)-6-[2-[(3R,4aS,5S,8aR)-3-hydroperoxy-5-hydroxy-2,5,8,8-tetramethyl-3,4,4a,6,7,8a-hexahydronaphthalen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
1 |
2 |
NPC273378 |
UNJUDVUHGWTTMH-DQVWNMBASA-N |
n.a. |
0 |
0 |
NPC266081 |
VKWZFIDWHLCPHJ-SEVDZJIVSA-M |
n.a. |
0 |
0 |
NPC64810 |
KBZJWPGSJWUHPT-PKTFCJAWSA-N |
n.a. |
0 |
0 |
NPC470838 |
(1R,E)-5-(2-((3R,5Ar,6R,7S,9Ar)-3,7-Dihydroxy-2,2,5A,7-Tetramethyl-Decahydrobenzo[B]Oxepin-6-Yl)Ethyl)-1-Hydroxy-1,4,4-Trimethyl-1,2,3,3A,4,5,8,8A-Octahydroazulene-6-Carbaldehyde |
(3R)-7-[2-[(3R,5aR,6R,7S,9aR)-3,7-dihydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethyl]-3-hydroxy-3,8,8-trimethyl-1,2,3a,4,7,8a-hexahydroazulene-6-carbaldehyde |
4 |
6 |
NPC105626 |
VYUQPLFRNDQDHW-BTRLNGJCSA-N |
n.a. |
0 |
0 |
NPC216312 |
Acetylalkannin |
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate |
20 |
36 |
NPC80280 |
MQGKFAGKLNYJRE-HWKANZROSA-N |
n.a. |
0 |
0 |
NPC135100 |
XRWWJGGSZAGWSN-PZWQJMSJSA-N |
n.a. |
0 |
0 |
NPC231511 |
RUHYVNDSXWCFOW-VPNZEDHFSA-N |
n.a. |
0 |
0 |
NPC14906 |
PUKRXQDEPWUWRC-SZZXRIAASA-N |
n.a. |
0 |
0 |
NPC62302 |
XRWWJGGSZAGWSN-AWIOYQLYSA-N |
n.a. |
0 |
0 |
NPC111422 |
Beta,Beta-Dimethylacrylalkannin |
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-methylbut-2-enoate |
18 |
32 |
NPC137059 |
FGCNBHJIMQXNDU-IXHFUHRASA-N |
n.a. |
0 |
0 |
NPC29771 |
Dimethylacrylshikonin |
[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-methylbut-2-enoate |
20 |
92 |
NPC20781 |
FGCNBHJIMQXNDU-GOVYHPCYSA-N |
n.a. |
0 |
0 |
NPC266084 |
(1R,2S)-1-(3,4-Dihydroxy-Phenyl)-6,7-Dihydroxy-1,2-Dihydro-Naphthalene-2,3-Dicarboxylic Acid Bis-[(R)-1-Carboxy-2-(3,4-Dihydroxy-Phenyl)-Ethyl] Ester |
(2R)-2-[(1R,2S)-3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-1-(3,4-dihydroxyphenyl)-6,7-dihydroxy-1,2-dihydronaphthalene-2-carbonyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid |
2 |
2 |
NPC306765 |
Deoxyshikonin |
5,8-dihydroxy-2-(4-methylpent-3-enyl)naphthalene-1,4-dione |
29 |
32 |
NPC51706 |
UVFOSIJDDUBTBX-NPUOQVLBSA-N |
n.a. |
0 |
0 |
NPC37992 |
Isobutylalkannin |
[(1S)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 2-methylpropanoate |
7 |
20 |
NPC70741 |
KSEBMYQBYZTDHS-HWKANZROSA-M |
n.a. |
0 |
0 |
NPC225089 |
RQSVDMLEQSPRMK-LJQANCHMSA-N |
n.a. |
0 |
0 |
NPC64 |
DOUMFZQKYFQNTF-WUTVXBCWSA-M |
n.a. |
0 |
0 |
NPC470840 |
(5Ar,6R,7S,9Ar)-7-Hydroxy-6-(2-((1R,E)-1-Hydroxy-6-(Hydroxymethyl)-1,4,4-Trimethyl-1,2,3,3A,4,5,8,8A-Octahydroazulen-5-Yl)Ethyl)-2,2,5A,7-Tetramethyl-Octahydrobenzo[B]Oxepin-3(2H)-One |
(5aR,6R,7S,9aR)-7-hydroxy-6-[2-[(1R)-1-hydroxy-6-(hydroxymethyl)-1,4,4-trimethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydrobenzo[b]oxepin-3-one |
4 |
6 |
NPC299405 |
Acetylshikonin |
[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] acetate |
23 |
49 |
NPC185622 |
RUHYVNDSXWCFOW-RDZGQKGGSA-N |
n.a. |
0 |
0 |
NPC150171 |
HWMFPBOZDKAOJC-FFAPIXEZSA-N |
n.a. |
0 |
0 |
NPC205917 |
OIMXTYUHMBQQJM-HSVWHVBGSA-N |
n.a. |
0 |
0 |
NPC94127 |
(2S,4As,5S,6R)-5-(2-((1S,3As,5R,8As)-1-Hydroxy-1,4,4,6-Tetramethyl-1,2,3,3A,4,5,8,8A-Octahydroazulen-5-Yl)Ethyl)-4A,6-Dimethyloctahydro-2H-Chromene-2,6-Diol |
(2S,4aS,5S,6R,8aS)-5-[2-[(1S,3aS,5R,8aS)-1-hydroxy-1,4,4,6-tetramethyl-2,3,3a,5,8,8a-hexahydroazulen-5-yl]ethyl]-4a,6-dimethyl-3,4,5,7,8,8a-hexahydro-2H-chromene-2,6-diol |
3 |
6 |
NPC242734 |
PEZOMNLHRUVLDV-AUUYWEPGSA-N |
n.a. |
0 |
0 |
NPC110609 |
Alkannin |
5,8-dihydroxy-2-[(1S)-1-hydroxy-4-methylpent-3-enyl]naphthalene-1,4-dione |
23 |
42 |
NPC79888 |
KHNJLGZZFHMTID-FDEHDGLQSA-N |
n.a. |
0 |
0 |
NPC189126 |
UTQDRWSHVALSEO-VNVYXMEHSA-N |
n.a. |
1 |
2 |
NPC127153 |
KBZJWPGSJWUHPT-DSFNJXJWSA-N |
n.a. |
2 |
2 |
NPC91439 |
Sipholenol K |
(4aR,8S,8aS)-4-[2-[(3S,5aS,6S,7S,9aS)-3,7-dihydroxy-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepin-6-yl]ethyl]-8-hydroxy-3,5,5,8-tetramethyl-4a,6,7,8a-tetrahydro-1H-naphthalen-2-one |
1 |
2 |
NPC145562 |
NFEVFCAOVZCHBN-NSHDSACASA-N |
n.a. |
0 |
0 |
NPC96590 |
FGCNBHJIMQXNDU-QYVUMVHSSA-N |
n.a. |
0 |
0 |
NPC161617 |
2,4-Dihydroxyacetophenone |
1-(2,4-dihydroxyphenyl)ethanone |
12 |
23 |
NPC476217 |
Siphonellinol E |
(3S,5aS,6S,7R,9aS)-6-[2-[(5R,6S)-6-(3-hydroperoxy-4-methylpent-4-enyl)-5-hydroxy-2,6-dimethylcyclohexen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
3 |
6 |
NPC246693 |
Shikonin |
5,8-dihydroxy-2-[(1R)-1-hydroxy-4-methylpent-3-enyl]naphthalene-1,4-dione |
740 |
909 |
NPC257003 |
Beta-Hydroxyisovalerylshikonin |
[(1R)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-enyl] 3-hydroxy-3-methylbutanoate |
15 |
25 |
NPC97103 |
Siphonellinol C-23-Hydroperoxide |
(3S,5aS,6S,7R,9aS)-6-[2-[(5R,6S)-6-[(E)-4-hydroperoxy-4-methylpent-2-enyl]-5-hydroxy-2,6-dimethylcyclohexen-1-yl]ethyl]-2,2,5a,7-tetramethyl-4,5,6,8,9,9a-hexahydro-3H-benzo[b]oxepine-3,7-diol |
3 |
6 |
NPC259733 |
Tomentic Acid |
(1R,2R,4aS,6aR,6aS,6bR,8aR,10R,11R,12aR,14bS)-1,10,11-trihydroxy-1,2,6a,6b,9,9,12a-heptamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
18 |
29 |
NPC105611 |
AROFVSZVAKNDAP-LFYBBSHMSA-N |
n.a. |
0 |
0 |