Exact Mass: 362.24569640000004
Exact Mass Matches: 362.24569640000004
Found 500 metabolites which its exact mass value is equals to given mass value 362.24569640000004
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
10beta,14beta-dihydroxytaxa-4(20),11-dien-5alpha-yl acetate
Epoxysiderol
Epoxysiderol is isolated from Sideritis species. Isolated from Sideritis subspecies
Annoglabasin B
Annoglabasin B is found in alcoholic beverages. Annoglabasin B is a constituent of Annona glabra (pond apple). Constituent of Annona glabra (pond apple). Annoglabasin B is found in alcoholic beverages and fruits.
Lycopersiconolide
Lycopersiconolide is found in garden tomato. Lycopersiconolide is a constituent of tomato roots. Constituent of tomato roots. Lycopersiconolide is found in garden tomato.
Dimethyl ent-16alpha-kaurane-17,19-dioate
Dimethyl ent-16alpha-kaurane-17,19-dioate is found in alcoholic beverages. Dimethyl ent-16alpha-kaurane-17,19-dioate is a constituent of Annona glabra (pond apple)
(Z)-2,4-Dihydroxy-6-(8-pentadecenyl)benzoic acid
(Z)-2,4-Dihydroxy-6-(8-pentadecenyl)benzoic acid is found in fats and oils. (Z)-2,4-Dihydroxy-6-(8-pentadecenyl)benzoic acid is a constituent of Ginkgo biloba (ginkgo). Constituent of Ginkgo biloba (ginkgo). (Z)-2,4-Dihydroxy-6-(8-pentadecenyl)benzoic acid is found in fats and oils.
19,20-DiHDPA
19,20-DiHDPA is one of the major metabolites produced when Docosahexaenoic acid (DHA) is incubated with NADPH-supplemented rat liver microsomes. Docosahexaenoic acid (DHA) is an essential fatty acid and the most abundant omega-3 fatty acid in neural tissues, especially in the retina and brain. DHA is also slowly metabolized by monkey seminal vesicles to 19,20-DiHDPA. The route of production likely proceeds through cytochrome P450-catalyzed epoxidation at the omega-3 double bond, followed by conversion to the vicinal diols by epoxide hydrolase. (PMID: 1742320) [HMDB] 19,20-DiHDPA is one of the major metabolites produced when Docosahexaenoic acid (DHA) is incubated with NADPH-supplemented rat liver microsomes. Docosahexaenoic acid (DHA) is an essential fatty acid and the most abundant omega-3 fatty acid in neural tissues, especially in the retina and brain. DHA is also slowly metabolized by monkey seminal vesicles to 19,20-DiHDPA. The route of production likely proceeds through cytochrome P450-catalyzed epoxidation at the omega-3 double bond, followed by conversion to the vicinal diols by epoxide hydrolase. (PMID: 1742320).
Annosquamosin A
Annosquamosin A is found in fruits. Annosquamosin A is a constituent of the seeds of Annona squamosa (sugar apple) Constituent of the seeds of Annona squamosa (sugar apple). Annosquamosin A is found in fruits.
ent-16a-Hydroxy-17-acetoxy-19-kauranal
ent-16a-Hydroxy-17-acetoxy-19-kauranal is found in fruits. ent-16a-Hydroxy-17-acetoxy-19-kauranal is a constituent of Annona squamosa (sugar apple). Constituent of Annona squamosa (sugar apple). ent-16a-Hydroxy-17-acetoxy-19-kauranal is found in fruits.
Rotundifuran
Rotundifuran is a labdane diterpenoid that is isolated from the fruits of Vitex rotundifolia. It has a role as a plant metabolite, an apoptosis inducer and an antineoplastic agent. It is a labdane diterpenoid, an acetate ester, a member of furans, a tertiary alcohol and a carbobicyclic compound. Rotundifuran is a natural product found in Vitex trifolia, Vitex rotundifolia, and Vitex agnus-castus with data available. See also: Chaste tree fruit (part of). A labdane diterpenoid that is isolated from the fruits of Vitex rotundifolia.
Methyl ent-16-methoxy-6-oxo-7,13E-labdadien-15-oate
2-hydroxy-5-methoxy-3-pentadec-10-enylcyclohexa-2,5-diene-1,4-dione
(5Z,9E,11E,14E)-Ethyl 8-hydroxy-13-oxoicosa-5,9,11,14-tetraenoate
11-O-Acetylcyathatriol
A tricyclic diterpenoid with formula C22H34O4. It is produced by the birds nest fungus Cyathus earlei.
(8E)-4alpha-acetoxy-12alpha,13alpha-epoxycembra-1(15),8-diene
2-Hydroxy-5-methoxy-3-pentadecenyl-benzochinon|2-Hydroxy-5-methoxy-3-pentadecenylbenzochinon
(-)-7-deacetoxyalcyonin acetate|(-)-deacetoxyalcyonin acetate|6-acetoxycladiell-7(16),11-dien-3-ol|deacetoxyalcyonin acetate
7-Ketone,17-Ac-(ent-7alpha,16beta)-7,16,17-Kauranetriol
2-hydroxy-5-methoxy-3-[8Z-pentadecene]-p-benzoquinone|sorgoleone-362
7-Ac-7,8-dihydroxy-15-isopimaren-3-one|7beta-acetoxy-8beta-hydroxy-15-isopimaren-3-one
(3beta,14beta)-3,14-dihydroxy-21-methoxypregn-5-en-20-one
16-hydroperoxy-3,4-seco-mansumbin-3(28),13(17)-dien-3-oic acid
methyl 15-formyloxy-1(10),13E-ent-halimadiene-18-oate
(+)-(1R*,3E,5S*,7E,11R*,12R*)-5-acetoxy-12-hydroxydolabella-3,7-dien-9-one|(1S*,3E,5R*,7E,11S*,12S*)-5-acetoxy-12-hydroxydolabella-3,7-dien-9-one
(2E,6Z,10E,12R)-7-[(acetyloxy)methyl]-12-hydroxy-3,11,15-trimethylhexadeca-2,6,10,14-tetraenal
(1R*,5S*,6R*,7S*,9Z)-dec<5.3.0>an-5-(3-acetoxy-1,5-dimethyl-4-en)-2(11),9-dien-6,8-diol|(1R*,5S*,6R*,7S*,9Z)-dec[5.3.0]an-5-(3-acetoxy-1,5-dimethyl-4-en)-2(11),9-dien-6,8-diol
(5R*,7S*,8S*,9S*,10R*,13S*,14*)-16-oxospongian-7-yl acetate
14, 17-Di-Me ether-17, 18-Epoxy-1(19), 7, 10, 12-xenicatetraene-6, 14, 17-triol
13,14-dihydroxy-1,8,12-trimethyl-4-methylidene-1,2,3,3a,4,5,6,7,8,9,10,12a-dodecahydro-1,11-ethanocyclopenta[11]annulen-5-yl acetate
(11alpha,13E)-11-(acetyloxy)-ent-cleroda-4(19),13-dien-15-oic acid|(2E,5R)-5-(acetoxy)-5-[(1S,2R,4aR,8aS)-decahydro-1,2,4a-trimethyl-5-methylenenaphthalen-1-yl]-3-methylpent-2-enoic acid|isocoparin A
3alpha,7beta-dihydroxy-18-acetoxy-ent-kaur-16-en; Linearol|ent-18-acetoxy-3beta,7alpha-dihydroxykaur-16-ene|ent-3beta,7alpha-dihydroxy-18-acetoxykaur-16-ene|linearol
14alpha,18-Dihydroxy-7beta-acetoxy-stach-15-en|7-acetylpusillatriol|ent-7alpha-Acetoxy-beyer-15-en-14beta,18-diol
14-acetylpusillatriol|ent-7alpha,18-dihydroxy-14beta-acetoxybeyer-15-ene
20-Ac-(2beta,3alpha)-1(15),8(19)-Trinervitadiene-2,3,20-triol|20-acetoxy-2beta,3alpha-dihydroxy-1(15),8(19)-trinervitadiene
16-acetoxy-12(R),15-epoxy-15beta-hydroxylabda-8(17),13(16)-diene|16-Acetoxy-12(R),15-epoxy-15??-hydroxylabda-8(17),13(16)-diene|16-acetoxy-12,15-epoxy-15-hydroxylabda-8(17),13(16)-diene
(4S*,9R*,14S*)-4-acetoxy-9,14-dihydroxydolasta-1(15),7-diene
7(SR)-acetoxy-4(SR),14(SR)-dihydroxydolast-1(15),8-diene
6alpha,11-dihydroxy-7beta,12-dimethoxyabieta-8,11,13-triene|fortunin C
(Z)-2,5-Dihydroxy-3-methyl-6-(10-pentadecenyl)-1,4-benzoquinone|maesanol
(1S*,4S*,9R*,11S*)-15-acetoxyxeniaphylla-8(19)-en-5,12-dione|gibberosin Q
3alpha,4alpha-epoxy-5alpha-acetoxy-18-hydroxysphenoloba-13E,16E-diene
6-Ac-8(14),15-Isopimaradiene-1,6,9-triol|6beta-acetoxysandaracopimaradien-1alpha,9alpha-diol
12-Ac-6,13-Epoxy-12-hydroxy-4(18)-eunicellen-9-one
7(R*)-acetoxy-4(R*),5(R*)-epoxy-11-keto-1(S*),10(S*)-cubata-8(Z),18(20)-diene
1beta-acetoxy-11beta,12-epoxy-7,17-sacculatadien-11alpha-ol
1(15),8(19)-trinervitadiene-3alpha,5alpha,18-triol 5-acetate
1beta-hydroxy-7alpha-acetyl-15beta,16beta-epoxykaurane
(1R*,2R*,3E,7E,11S*,12S*)-2-acetoxy-12-hydroxydolabella-3,7-dien-9-one
(-)-17-acetoxyspongian-16-one|17-acetoxyspongian-16-one|isoaplyroseol-14
(+)-(1S,2R,11S,12R,15S,3E,7E)-11-acetoxy-2,12-oxa-15,17-epoxycembra-3,7-diene
(+)-2-hydroxy-6-(10-hydroxypentadec-80(E)-enyl)benzoic acid
(2S,7S,8R,3E,11E)-7-acetoxy-8-hydroxycembra-3,11-diene|crassumol C|sarcophytonin G
(1R,3S,4S,7S,11S,12S,14S)-14-acetoxy-3,4-epoxy-7-hydroxy-8(17),18-dolabelladiene
11alpha-aacetoxyspongian-16-one|11alpha-acetoxyspogian-16-one
ethyl 15-hydroxy-9-oxo-5Z,8(12),13E-prostatrienoate|PGB2 ethyl ester|prostaglandin B2 ethyl ester
13-epi-9,13,15,16-bisepoxy-labdane-7-ene-6,15-dione
16-Ac-15,16-Dihydroxy-3-erythroxylen-7-one|16-O-Acetylfagonone
21-O-Methyl-5,14-pregndiene-3??,14??,17??,21-tetrol
6beta,13beta-dihydroxy-18-acetoxycassan-14(17),15-diene
1-carboxy-11-carbomethoxy-3,7,15-trimethyl-hexa-deca-2E,6E,10E,14-tetraene
18-O-acetylsideroxol|ent-7alpha-hydroxy-18-acetoxy-15beta,16beta-epoxykaurane
12-Acetyl-jativatriol|ent-12alpha-acetoxy-1beta,17-dihydroxy-beyer-15-ene
(4R,7R,14S)-4-acetoxy-7,14-dihydroxydolast-1(15),8-diene
Ac-7beta-7-Hydroxy-13(17),15-cleistanthadien-18-oic acid
(13S)-ent-9,1-friedolabd-1(10)-en-15-acetoxy-2R,18-olide
ent-(16S)-18-Acetoxy-7??-hydroxykauran-15-one|ent-16(S)-18-acetoxy-7beta-hydroxykaur-15-one
11R*-acetoxykolavenic acid|11R*-acetoxyneocleroda-3,13E-dien-15-oic acid
(3R,4S,5S,17R,20R)-3,17,20-trihydroxy-4-methylpregn-8-en-7-one
O-(3-Ethyl-2Z-butenoyl),Me ester-2alpha-2-Hydroxy-4(15),11(13)-eudesmadien-12-oic acid
6-beta-Acetoxy-labda-8(17)-en-15-saeuremethylester
C22H34O4_7-Oxabicyclo[4.1.0]hept-3-ene-2,5-diol, 4-(hydroxymethyl)-1-[(1,4,4a,5,6,7,8,8a-octahydro-2,5,5,8a-tetramethyl-1-naphthalenyl)methyl]
6-[(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
6-[(2,5,5,8a-tetramethyl-1,4,4a,6,7,8-hexahydronaphthalen-1-yl)methyl]-3-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol_major
19,20-DiHDPA
A DiHDPA obtained by formal dihydroxylation of the 19,20-double bond of docosa-4,7,10,13,16,19-hexaenoic acid.
Annosquamosin A
Annoglabasin B
Lycopersiconolide
Dimethyl ent-16a-kaurane-17,19-dioate
Epoxysiderol
Annosquamosin a?
Resolvin T4
A docosanoid that is (8E,10Z,14E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 7 and 13.
6-((Z)-14-hydroxypentadec-8-en-1-yl)salicylic acid
2-Hydroxy-5-methoxy-3-((e)-pentadec-10-enyl)[1,4]benzoquinone
Dimethyl ent-16alpha-kaurane-17,19-dioate
Dimethyl ent-16alpha-kaurane-17,19-dioate is found in alcoholic beverages. Dimethyl ent-16alpha-kaurane-17,19-dioate is a constituent of Annona glabra (pond apple) Constituent of Annona glabra (pond apple). Dimethyl ent-16a-kauran-17,19-dioate is found in alcoholic beverages and fruits.
1-[(2,5,5,8A-Tetramethyl-1,4,4A,6,7,8-hexahydronaphthalen-1-YL)methyl]-4-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-ene-2,5-diol
(7Z,10R,11E,13E,15Z,17S,19Z)-10,17-dihydroxydocosa-7,11,13,15,19-pentaenoic acid
(7R,8E,10E,12Z,14S,16Z,19Z)-7,14-dihydroxydocosa-8,10,12,16,19-pentaenoic acid
[(1S,3S,5S,8S,10S)-10,14-dihydroxy-8,12,15,15-tetramethyl-4-methylidene-5-tricyclo[9.3.1.03,8]pentadec-11-enyl] acetate
(8Z,15E,19Z)-7,17-dihydroxydocosa-8,10,13,15,19-pentaenoic acid
16alpha-Hydro-19-acetoxy-19-al-ent-kauran-17-oic acid
(8E,10Z,13Z,15E,19Z)-7,17-dihydroxydocosa-8,10,13,15,19-pentaenoic Acid
(7Z,10Z,12E,14S,16Z,19Z)-14,21-dihydroxydocosa-7,10,12,16,19-pentaenoic acid
(7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid
(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid
(7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosa-7,10,13,15,19-pentaenoic acid
3-Acetoxylabda-8(20),13-dien-15-oic acid
A natural product found in Metasequoia glyptostroboides.
(7Z,10Z,12E,14E,17S,19Z)-16,17-dihydroxydocosa-7,10,12,14,19-pentaenoic acid
(7Z,9E,11E,14S,16Z,19Z)-13,14-dihydroxydocosa-7,9,11,16,19-pentaenoic acid
(7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosa-7,10,12,16,19-pentaenoic acid
(4Z,7Z,10Z,12E,16Z)-14-hydroperoxydocosa-4,7,10,12,16-pentaenoic acid
(4Z,7Z,10Z,13Z,15E,17S)-17-hydroperoxydocosa-4,7,10,13,15-pentaenoic acid
(6E,10E)-1-Aetoxy-14-(1-methyl-1,2-epoxyethyl)-2,3-epoxy-3,7,11-trimethylcyclotetradecadiene
2-[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]oxyacetic acid
(+/-)-7,8-dihydroxy-4Z,10Z,13Z,16Z,19Z-docosapentaenoic acid
(+/-)-10,11-dihydroxy-4Z,7Z,13Z,16Z,19Z-docosapentaenoic acid
(+/-)-16,17-dihydroxy-4Z,7Z,10Z,13Z,19Z-docosapentaenoic acid
Epoxypholamin D, (rel)-
A natural product found in Paraconiothyrium species.
(10R,17S)-dihydroxy-(7Z,11E,13E,15Z,19Z)-docosapentaenoic acid
A dihydroxydocosapentaenoic acid (DiHDPE) that is (7Z,11E,13E,15Z,19Z)-docosapentaenoic acid in which the hydrogens at the 10 pro-R and 17 pro-S positions have been replaced by hydroxy groups. It is an intermediate of specialized proresolving mediators.
(+/-)-13,14-dihydroxy-4Z,7Z,10Z,16Z,19Z-docosapentaenoic acid
(7R,14S)-dihydroxy-(8E,10E,12Z,16Z,19Z)-docosapentaenoic acid
A docosanoid that is (8E,10E,12Z,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 7R and 14S. An intermediate of specialised proresolving mediators.
14(S),21-dihydroxy-(7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid
A docosanoid that is (7Z,10Z,12E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 14S and 21. An intermediate of specialised proresolving mediators.
(7Z,10Z,13Z,15E,17S,19Z)-17-hydroperoxydocosapentaenoic acid
A (7Z,10Z,13Z,15E,19Z)-17-hydroperoxydocosapentaenoic acid in which the chiral centre at position 17 has S-configuration. An intermediate of specialised proresolving mediators.
16,17(S)-dihydroxy-(7Z,10Z,13E,14E,19Z)-docosapentaenoic acid
A dihydroxydocosapentaenoic acid (DiHDPE) that is (7Z,10Z,13E,14E,19Z)-docosapentaenoic acid carrying two hydroxy substituents at the 16 and 17-S positions. It is an intermediate of specialised proresolving mediators.
13,14(S)-dihydroxy-(7Z,9E,11E,16Z,19Z)-docosapentaenoic acid
A docosanoid that is (7Z,9E,11E,16Z,19Z)-docosapentaenoic acid carrying two hydroxy substituents at positions 13 and 14. An intermediate of specialised proresolving mediators.
(7Z,10Z,12E,14S,16Z,19Z)-14-hydroperoxydocosapentaenoic acid
A (7Z,10Z,12E,16Z,19Z)-14-hydroperoxydocosapentaenoic acid in which the chiral centre at position 14 has S-configuration. An intermediate of specialised proresolving mediators.
7,17-dihydroxy-(8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoic acid
A dihydroxydocosapentaenoic acid (DiHDPE) that is (8Z,15E,19Z)-docosa-8,10,13,15,19-pentaenoic acid carrying two hydroxy substituents at positions 7 and 17. An intermediate of specialized proresolving mediators
DG(19:5)
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[(1s,4s,5r,9s,10r,13s,14s)-5-formyl-14-hydroxy-5,9-dimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl]methyl acetate
{2,6-dihydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl}methyl acetate
(2e)-5-[(1r,2s,3s,4ar,8ar)-3-(acetyloxy)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-methylpent-2-enoic acid
(1s,2s,3r,4r,5r,7s,8r,11s,14z,17s)-5,8,11,15-tetramethyl-10,18-dioxatetracyclo[9.7.0.0²,⁷.0³,¹⁷]octadec-14-en-4-yl acetate
2'',5'',5'',8''a-tetramethyl-3'',4'',4''a,6'',7'',8''-hexahydro-2h,2''h-dispiro[furan-3,2'-oxolane-5',1''-naphthalen]-4''-yl acetate
methyl 5-(5-methoxy-3-methyl-5-oxopent-3-en-1-yl)-1,4a-dimethyl-6-methylidene-hexahydro-2h-naphthalene-1-carboxylate
(1s,3r,4r,4as,8as)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-hexahydro-1h-naphthalen-1-yl acetate
4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-hexahydro-1h-naphthalen-1-yl acetate
5-[6-(acetyloxy)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-2-enoic acid
(1r,3ar,4as,8r,8ar)-1,4a-dihydroxy-1-isopropyl-3a,8a-dimethyl-5-methylidene-2h,3h,4h,6h,7h,8h,9h-cyclohexa[f]azulen-8-yl acetate
(1r,3r,6r,10r,12s,13s)-3-ethyl-13,17-dihydroxy-4,6,10,12-tetramethyl-16-oxatricyclo[12.2.1.0¹,⁶]heptadeca-4,14(17)-dien-15-one
(2z)-5-[(1r,4ar,8ar)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-[(acetyloxy)methyl]pent-2-enoic acid
(2e)-5-[(1s,4ar,6s,8as)-6-(acetyloxy)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpent-2-enoic acid
1-{3a,7-dihydroxy-9a,11a-dimethyl-1h,2h,3h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}-2-methoxyethanone
methyl 5-(5-methoxy-3-methyl-5-oxopent-3-en-1-yl)-1,5,6-trimethyl-2,3,6,7,8,8a-hexahydronaphthalene-1-carboxylate
(1s,3br,7s,9ar,9bs,11as)-1-[(1s)-1-hydroxy-2-methoxyethyl]-9a,11a-dimethyl-2h,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthrene-1,7-diol
2-hydroxy-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-6-yl acetate
3-[(2s,5ar,6s,7s,9ar,9br)-2-hydroperoxy-6,9a,9b-trimethyl-7-(prop-1-en-2-yl)-1h,2h,4h,5h,5ah,7h,8h,9h-cyclopenta[a]naphthalen-6-yl]propanoic acid
(1s,3s,5s,8s,10s,14s)-10,14-dihydroxy-8,12,15,15-tetramethyl-4-methylidenetricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl acetate
(5z,8r)-8-[(1r,2r)-2-[(1r,2e,4s,6z)-1,4-dihydroxydodeca-2,6-dien-1-yl]cyclopropyl]-3,4,7,8-tetrahydrooxocin-2-one
[(1r,2s,4r,5s,6r,9s,10s,13r)-2,6-dihydroxy-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl]methyl acetate
(1s,5r,6s)-5-hydroxy-1-(11-hydroxy-3,7,11-trimethyldodeca-2,6-dien-1-yl)-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-2-one
5-(1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl)-5-(acetyloxy)-3-methylpent-2-enoic acid
[(3ar,5ar,6s,9r,10ar)-6,9-dihydroxy-1-isopropyl-3a,5a-dimethyl-2h,3h,4h,5h,6h,9h,10h,10ah-cyclohepta[e]inden-8-yl]methyl acetate
(1s,4as)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-hexahydro-1h-naphthalen-1-yl acetate
(2e,6e,10e)-12-(acetyloxy)-6,10-dimethyl-2-(4-methylpent-3-en-1-yl)dodeca-2,6,10-trienoic acid
2-hydroxy-5-methoxy-3-(pentadec-10-en-1-yl)cyclohexa-2,5-diene-1,4-dione
7-(3-hydroxy-3-methylpent-4-en-1-yl)-2,3,6-trimethyl-10-oxotricyclo[5.3.1.0³,⁸]undecan-4-yl acetate
(1r,6r,10e,14s)-6,10,14-trimethyl-2-oxo-3-(propan-2-ylidene)-15-oxabicyclo[12.1.0]pentadec-10-en-6-yl acetate
7-hydroxy-4-isopropyl-1,7,11-trimethyl-15-oxabicyclo[12.1.0]pentadeca-3,5,10-trien-2-yl acetate
(1r,4ar,8as)-1-[(3e)-5-(acetyloxy)-3-methylpent-3-en-1-yl]-5,5,8a-trimethyl-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid
6-(acetyloxy)-5,5,9-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecane-14-carboxylic acid
4,7'-dihydroxy-2',4'b,8',8',10'a-pentamethyl-2',3',4',4'a,5',6',7',8'a,9',10'-decahydrospiro[furan-2,1'-phenanthren]-5-one
{14-hydroxy-5,5,9-trimethyl-6-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl}methyl acetate
(1s,3s,4z,6r,9r,12s)-4-isopropyl-1,9-dimethyl-7-oxo-6-(prop-1-en-2-yl)-13-oxabicyclo[10.1.0]tridec-4-en-3-yl acetate
1,7-dihydroxy-1-(1-hydroxyethyl)-6,9a,11a-trimethyl-2h,3h,3ah,5h,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-4-one
[(1s,4r,9r,10r,13s,14r)-14-hydroxy-5,5,9-trimethyl-11-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl]methyl acetate
{2-hydroxy-5,9,14-trimethyl-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl}methyl acetate
(1r,4s,5s,6r,9s,10s,13r,16s)-16-hydroxy-5-(hydroxymethyl)-5,9,13-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-6-yl acetate
(1r,6s,11s,12r,13r,15s)-11-hydroxy-12-(hydroxymethyl)-6,16-dimethyl-2-methylidenetricyclo[7.5.2.0¹²,¹⁵]hexadec-9(16)-en-13-yl acetate
(1r,2s,4s,5s,6r,9s,10s,13r)-2-hydroxy-5-(hydroxymethyl)-5,9,14-trimethyltetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadec-14-en-6-yl acetate
5-{6,10-dimethyl-2-methylidene-5-oxobicyclo[7.2.0]undecan-10-yl}-2-methyl-5-oxopentan-2-yl acetate
8-(acetyloxy)-7-isopropyl-1,4a-dimethyl-2,3,4,4b,5,6,7,8,10,10a-decahydrophenanthrene-1-carboxylic acid
(2z,6e)-2-[(3e,5r)-5-hydroxy-4,8-dimethylnona-3,7-dien-1-yl]-6-methyl-8-oxoocta-2,6-dien-1-yl acetate
3-hydroxy-2-{[2-hydroxy-2-methyl-5-(6-methylhepta-2,5-dien-2-yl)cyclopentyl]methyl}-4-methoxycyclohex-2-en-1-one
1, 2-Benzene dicarboxylic acid, 2-ethylhexyl ester
{"Ingredient_id": "HBIN000722","Ingredient_name": "1, 2-Benzene dicarboxylic acid, 2-ethylhexyl ester","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42012","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1 , 2-Benzenedicarboxylic acid, dipropyl este
{"Ingredient_id": "HBIN000731","Ingredient_name": "1 , 2-Benzenedicarboxylic acid, dipropyl este","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42214","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-hydroperoxy-3,4-seco-mansumbin-3(28),13(17)- dien-3-oic acid
{"Ingredient_id": "HBIN001903","Ingredient_name": "16-hydroperoxy-3,4-seco-mansumbin-3(28),13(17)- dien-3-oic acid","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CC(=C)C1CCC2(C(C1(C)CCC(=O)O)CCC3=CC(CC32C)OO)C","Ingredient_weight": "362.5 g/mol","OB_score": "9.285835804","CAS_id": "NA","SymMap_id": "SMIT03530","TCMID_id": "NA","TCMSP_id": "MOL001051","TCM_ID_id": "NA","PubChem_id": "101630484","DrugBank_id": "NA"}
21-o-methyl-5,14-pregndiene-3β,14β,17β,21-tetrol
{"Ingredient_id": "HBIN003589","Ingredient_name": "21-o-methyl-5,14-pregndiene-3\u03b2,14\u03b2,17\u03b2,21-tetrol","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CC12CCC(CC1=CCC3C2CCC4(C3=CCC4(C(COC)O)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14676","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-hydroxy-5-methoxy-3-pentadecenyl benzoquinone
{"Ingredient_id": "HBIN005762","Ingredient_name": "2-hydroxy-5-methoxy-3-pentadecenyl benzoquinone","Alias": "2-hydroxy-5-methoxy-3-pentadecenylbenzoquinone","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CC=CCCCCCCCCCCCCC1=C(C(=O)C=C(C1=O)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31224;10430","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7β-acetoxytrachyloban-18-oicacid
{"Ingredient_id": "HBIN013096","Ingredient_name": "7\u03b2-acetoxytrachyloban-18-oicacid","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "291","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
aglatomin b
{"Ingredient_id": "HBIN014864","Ingredient_name": "aglatomin b","Alias": "NA","Ingredient_formula": "C22H34O4","Ingredient_Smile": "CC12CCC3C(C1CC(=O)OC2C=C)CCC4C3(CC(C(C4)O)OC)C","Ingredient_weight": "362.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "743","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "15485742","DrugBank_id": "NA"}