Exact Mass: 486.3206
Exact Mass Matches: 486.3206
Found 500 metabolites which its exact mass value is equals to given mass value 486.3206
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(2S)-2-[[(2S)-2-[[(2S)-2-Amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Hovenine A
Hovenine A is an alkaloid from the root bark of Hovenia dulcis (raisin tree
(2S)-2-[[(2S)-2-[[(2S)-2-Amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
12(R)-(3-O-acetyl-beta-D-glucopyranosyloxy)octadecanoic acid 1,2-cyclic ester|gallicaside E
Hovenine A
8alpha,13beta-dihydroxy-labd-14-en-3beta-O-beta-D-glucopyranoside
ent-14-labden-8alpha,13alpha-diol 19-O-beta-D-glucopyranoside
ent-14-labden-8alpha,18-diol 13alpha-O-beta-D-glucopyranoside
19-beta-D-glucopyranosyloxy-labd-13(E)-en-8alpha,15-diol
13(R)-(6-O-acetyl-beta-D-glucopyranosyloxy)octadecanoic acid 1,2-cyclic ester|gallicaside F
12(R)-(6-O-acetyl-beta-D-glucopyranosyloxy)octadecanoic acid 1,2-cyclic ester|gallicaside G
3beta,19alpha,23-trihydroxy-13alpha,27-cyclours-11-en-28-oic acid,|euscaphic acid B
(2alpha,3beta)-form-2,3,23-Trihydroxy-12,19-ursadien-28-oic acid
16alpha,23alpha-epoxy-2beta,3beta,20beta-trihydroxy-10alpha,23alpha-cucurbit-5,24-dien-11-one
3,8-Dioxo-7??-hydroxy-7,9-cyclo-7,8-seco-24Z-tirucalladien-26-oic acid
2-ethoxycarbonyl-2beta,6beta-dihydroxy-A-nor-ergosta-5,24(28)-dien-4-one
(5R,8S,9S,10S,13R,14S,17R)-17-(4,6-dihydroxy-6-methyl-5-oxoheptan-2-yl)-1,8,10,11,12,13.14,15,16,17-decahydro-4,4,13,14.tetramethyl-2H-5,9-(epoxymethano)cyclopenta[a]phenanthren-3(4H)-one|23,25-dihydroxy-5beta,19-epoxycucurbit-6-ene-3,24-doine
3beta,6beta-dihydroxy-11alpha,12alpha-epoxyolean-28,13beta-olide
27-nor-5alpha-cholestane-3beta,4beta,5,6alpha,8,14,15alpha,24alpha-octanol
16alpha-hydroxy-3,4-seco-lanosta-4(28),8,24-triene-3,21-dioic acid (20R)|poricoic acid G
(2alpha,3beta)-form-2,3,23-Trihydroxy-12,18-ursadien-28-oic acid
Ile Lys Ala Arg
2a,3a,23-Trihydroxyurs-12,20(30)-dien-28-oic acid
38P86ZU018
Ceanothic acid is a natural product found in Alphitonia excelsa, Alphitonia petriei, and other organisms with data available.
2α,19α-Dihydroxy-3-oxo-urs-12-en-28-oic acid
2alpha,19alpha-dihydroxy-3-oxo-12-ursen-28-oic acid is a pentacyclic triterpenoid that is urs-12-ene substituted by a carboxy group at position 28, alpha-configured hydroxy groups at positions 2 and 19 and an oxo group at position 3. Isolated from the whole plants of Geum japonicum, it exhibits activity against HIV-1 protease. It has a role as a metabolite and a HIV protease inhibitor. It is an oxo monocarboxylic acid, a diol, a pentacyclic triterpenoid and a secondary alpha-hydroxy ketone. It derives from a hydride of an ursane. 2alpha,19alpha-Dihydroxy-3-oxo-12-ursen-28-oic acid is a natural product found in Rhaphiolepis deflexa, Geum japonicum, and Geum macrophyllum with data available. A pentacyclic triterpenoid that is urs-12-ene substituted by a carboxy group at position 28, alpha-configured hydroxy groups at positions 2 and 19 and an oxo group at position 3. Isolated from the whole plants of Geum japonicum, it exhibits activity against HIV-1 protease.
11-Anhydro-16-oxoalisol A
4,4,8,10,14-pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-2,5,6,7,9,15-hexahydro-1H-cyclopenta[a]phenanthrene-3,16-dione
C30H46O5_(1R,2S,5aR,5bR,7aS,10R,12bR)-2-Hydroxy-10-isopropenyl-3,3,5a,5b,12b-pentamethyloctadecahydrodicyclopenta[a,i]phenanthrene-1,7a(1H)-dicarboxylic acid
(1R,2R,5S,8R,14R,15R,16S)-16-hydroxy-1,2,14,17,17-pentamethyl-8-(prop-1-en-2-yl)pentacyclo[11.7.0.0²,¹⁰.0⁵,⁹.0¹⁴,¹⁸]icosane-5,15-dicarboxylic acid
4,4,8,10,14-pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-2,5,6,7,9,15-hexahydro-1H-cyclopenta[a]phenanthrene-3,16-dione [IIN-based on: CCMSLIB00000846960]
4,4,8,10,14-pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-2,5,6,7,9,15-hexahydro-1H-cyclopenta[a]phenanthrene-3,16-dione [IIN-based: Match]
Ala Ile Lys Arg
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Docosahexaenoyl Serotonin
Bassic acid
28-Hydroxyglycyrrhetic acid
24-Hydroxyglycyrrhetic acid
(3beta,15alpha,22S,24E)-3,15,22-Trihydroxylanosta-7,9(11),24-trien-26-oic acid
(2xi,20beta)-2,20-Dihydroxy-3-oxo-12-ursen-28-oic acid
Emmolic acid
Constituent of Ceanothus americanus (New Jersey tea) and Zizyphus jujuba (Chinese date). Ceanothic acid is found in tea and fruits.
Actinidic acid
A pentacyclic triterpenoid that is ursa-12,20(30)-diene substituted by a carboxy group at position 28 and hydroxy groups at positions 2, 3 and 23. It is a phytoalexin isolated from the peel of unripe kiwi fruit Actinidia deliciosa.
Melilotigenin
18a-Hydroxyglycyrrhetic acid
3alpha,23-dihydroxy-30-oxolup-20(29)-en-28-oic acid
1-Oxo-3beta,23-dihydroxyolean-12-en-28-oic acid
A natural product found in Juglans sinensis.
2-Hydroxyrubiarbonone E
A pentacyclic triterpenoid of the class of arborinane-type terpenoids isolated from the roots of Rubia yunnanensis.
(2S)-2-[[(2S)-2-[[(2S)-2-Amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
4,4,8,10,14-Pentamethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-2,5,6,7,9,15-hexahydro-1H-cyclopenta[a]phenanthrene-3,16-dione
[(2R,3R,4R,5R)-2-[(1S,2S,3R,4S,6R)-4,6-bis(azaniumyl)-3-[(2R,3R,4R,5S,6R)-3-azaniumyl-6-(azaniumylmethyl)-4,5-dihydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,5-dihydroxy-5-methyloxan-4-yl]-methylazanium
(3S,4S,6aR,6bS,8aS,14bR)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
9-[(E,5S,6S)-5,6-dihydroxy-6-[(2R,3R,5S)-5-[(2R,3S)-3-hydroxy-2-methylbutyl]-3-methyloxolan-2-yl]-3-methylhex-2-enoyl]oxynonanoic acid
9-[(2E,5S,6S,7R,8R,10E,12R,13S)-5,6,7,13-tetrahydroxy-3,8,12-trimethyltetradeca-2,10-dienoyl]oxynonanoic acid
Celastolide
A hexacyclic triterpenoid with formula C30H46O5, originally isolated from Tripterygium hypoglaucum.
(1R,2R,5S,8R,14R,15R,16S)-16-hydroxy-1,2,14,17,17-pentamethyl-8-prop-1-en-2-ylpentacyclo[11.7.0.02,10.05,9.014,18]icosane-5,15-dicarboxylic acid
(E,4S,6R)-4-hydroxy-6-[(10R,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,9,11,12,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid
(1-hydroxy-3-pentanoyloxypropan-2-yl) (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate
[3-hydroxy-2-[(E)-undec-4-enoyl]oxypropyl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
(1s,2s,6s,7s,8r,10r,11s,14s,15r,18r,20r)-10,20-dihydroxy-7,8,14,15,19,19-hexamethyl-21-oxahexacyclo[18.2.2.0¹,¹⁸.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹]tetracos-4-ene-11-carboxylic acid
3,10-dihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-7-oxo-3,4,5,6,8,8a,10,11,12,12b,13,14b-dodecahydro-1h-picene-4a-carboxylic acid
(1r,3as,5ar,5br,7ar,8s,9r,11as,11br,12r,13ar,13br)-8-formyl-9,12-dihydroxy-5a,5b,8,11a-tetramethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
(2e,5r)-6-[(1r,3s,3ar,7r,9as,11ar)-3,7-dihydroxy-3a,6,6,9a,11a-pentamethyl-1h,2h,3h,5h,5ah,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-5-hydroxy-2-methylhept-2-enoic acid
2-({5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(1s,3br,4r,5ar,9ar,9br,11as)-1-[(3s,5r)-5-[(2s)-3,3-dimethyloxiran-2-yl]-2-hydroxyoxolan-3-yl]-4-hydroxy-3b,6,6,9a,11a-pentamethyl-1h,2h,4h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
2-[(1s,3r,5r,6r,7e,10s)-1,10-dihydroxy-6-(3-hydroxypropyl)-10-methyl-3-[(1e,3e,5e)-2,6,10-trimethylundeca-1,3,5,9-tetraen-1-yl]-2-oxaspiro[4.5]decan-7-ylidene]propanal
4-{[3-hydroxy-4-(2-hydroxy-6-methylheptan-2-yl)phenyl]methyl}-2-(2-hydroxy-6-methylheptan-2-yl)-5-(hydroxymethyl)phenol
(1r,3as,5ar,5br,8r,9r,11ar)-9-hydroxy-8-(hydroxymethyl)-5a,5b,8,11a-tetramethyl-1-(3-oxoprop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysene-3a-carboxylic acid
(3r,4r,4as,6as,6br,8ar,10r,12as,12br)-3,4,10-trihydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b-dodecahydropicene-4a-carboxylic acid
{14-hydroxy-5,5,9-trimethyl-6-[(2-methylbut-2-enoyl)oxy]tetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-14-yl}methyl 2-methylbut-2-enoate
3-[7-(2-hydroxypropan-2-yl)-3a,6,9b-trimethyl-3-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-6-yl]propanoic acid
(4as,4br,6r,6as,7r,10as,10br,12as)-8-acetyl-7-formyl-1,1,4a,6a,10b-pentamethyl-2,3,4,4b,5,6,7,10,10a,11,12,12a-dodecahydrochrysen-6-yl (3s)-3-hydroxybutanoate
2-[6-(2-carboxyethyl)-1-hydroxy-3a,6,9b-trimethyl-7-(prop-1-en-2-yl)-1h,2h,3h,4h,5h,7h,8h,9h-cyclopenta[a]naphthalen-3-yl]-6-methylhept-5-enoic acid
2-{2,7-dihydroxy-3a,6,6,9b,11a-pentamethyl-10-oxo-1h,2h,3h,3bh,4h,7h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl}-2,6,6-trimethyloxan-3-one
14,14b-dihydroxy-2,4a,6a,9,9,12a,14a-heptamethyl-10-oxo-1,3,4,5,6,8,8a,11,12,12b,13,14-dodecahydropicene-2-carboxylic acid
21-hydroxy-5,8,11,14,17,24-hexamethyl-20-oxo-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracosane-11-carboxylic acid
(1r,3as,5as,5br,7ar,9s,11ar,11br,13ar,13br)-9-hydroxy-5b,8,8,11a-tetramethyl-1-(prop-1-en-2-yl)-hexadecahydrocyclopenta[a]chrysene-3a,5a-dicarboxylic acid
(1s,2s,4s,5r,6s,9s,11r,12r,14r,15s,18s,23r)-9,12-dihydroxy-6,10,10,14,15,21,21-heptamethyl-3,24-dioxaheptacyclo[16.5.2.0¹,¹⁵.0²,⁴.0⁵,¹⁴.0⁶,¹¹.0¹⁸,²³]pentacosan-25-one
(4as,6ar,6br,8ar,10r,12ar,12br)-10-hydroxy-2,2,6b,9,9,12a-hexamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14-tetradecahydropicene-4a,6a-dicarboxylic acid
(3s,4s,4ar,6ar,6bs,8as,12ar,14ar,14br)-3-hydroxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4,8a-dicarboxylic acid
(2s)-n-[(3r,4r,7r,10z)-7-[(2s)-butan-2-yl]-5,8-dihydroxy-3-isopropyl-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-4-methyl-2-(methylamino)pentanimidic acid
(1r,2r,3r,7r,9s,12r,14r,17r,18r,19r,21r,22s)-22-(2-hydroxypropan-2-yl)-3,8,8,17,19-pentamethyl-23,24-dioxaheptacyclo[19.2.1.0¹,¹⁸.0³,¹⁷.0⁴,¹⁴.0⁷,¹².0¹²,¹⁴]tetracos-4-ene-2,9-diol
2-formyl-10-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
(3z,3as,5ar,6s,7s,9ar,9bs)-3-[(3e,5e,7e)-9,10-dihydroxy-6,10-dimethylundeca-3,5,7-trien-2-ylidene]-7-hydroxy-6-(hydroxymethyl)-3a,6,9a-trimethyl-octahydrocyclopenta[a]naphthalen-2-one
1,10-dihydroxy-9-(hydroxymethyl)-1,6a,6b,9,12a-pentamethyl-2-methylidene-4,5,6,7,8,8a,10,11,12,12b,13,14b-dodecahydro-3h-picene-4a-carboxylic acid
(4as,6ar,6br,8as,9r,10r,11s,14bs)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,8a,9-hexamethyl-1,3,4,5,6,7,8,10,11,12,13,14b-dodecahydropicene-4a-carboxylic acid
2-[1,10-dihydroxy-2-(1-hydroxy-10-methyl-6-methylideneundeca-2,4,9-trien-2-yl)-6-(3-hydroxypropyl)-10-methylspiro[4.5]decan-7-ylidene]propanal
(2s,3r,4s,5s,6r)-2-{[(3s)-5-[(1s,2s,4as,5r,8ar)-2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-hexahydro-1h-naphthalen-1-yl]-3-methylpent-1-en-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
2-({5-[4-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]-3-methylpentyl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,4s,5s,8r,9r,12s,13s)-8-[(2r,4r)-4,6-dihydroxy-6-methyl-5-oxoheptan-2-yl]-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-2-en-16-one
2-(2-hydroxy-6-methylheptan-2-yl)-5-[2-(2-hydroxy-6-methylheptan-2-yl)-5-(hydroxymethyl)phenoxymethyl]phenol
(1's,2s,2's,4s,4's,7'r,8'r,9's,12's,13'r,16's)-7'-hydroxy-4,5,5,7',9',13'-hexamethyl-5'-oxaspiro[oxolane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-en-16'-yl acetate
n-[5,8-dihydroxy-3-isopropyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-2-(dimethylamino)-3-methylbutanimidic acid
8-(4,6-dihydroxy-6-methyl-5-oxoheptan-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-2-en-16-one
methyl (4r,4ar,6as,6br,8ar,9s,11r,12as,12bs,14ar,14br)-9-hydroxy-4,6b,8a,11,12b,14a-hexamethyl-3,10-dioxo-tetradecahydro-1h-picene-4a-carboxylate
2-[(1s,2s,5s,6r,7z,10s)-1,10-dihydroxy-2-[(3e,5z)-7-hydroxy-6-(4-methylpent-3-en-1-yl)hepta-1,3,5-trien-2-yl]-6-(3-hydroxypropyl)-10-methylspiro[4.5]decan-7-ylidene]propanal
(1r,4s,5r,8s,11r,13r,14s,17r,18s,21r,24r)-21-hydroxy-5,8,11,14,17,24-hexamethyl-20-oxo-22-oxahexacyclo[19.2.1.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracosane-11-carboxylic acid
1-[4-(3,3-dimethyloxiran-2-yl)-4-oxobutan-2-yl]-9-hydroxy-6-(hydroxymethyl)-3a,6,9a,11a-tetramethyl-1h,2h,3h,5h,5ah,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
(2s)-n-[(3s,4s,7r,10z)-5,8-dihydroxy-3-isopropyl-7-(2-methylpropyl)-2-oxa-6,9-diazabicyclo[10.2.2]hexadeca-1(14),5,8,10,12,15-hexaen-4-yl]-2-(dimethylamino)-3-methylbutanimidic acid
14β,15β-epoxy-3α-hydroxy-9-oxo-11(10→8)-abeolanost-24-trans-en-26-oicacid
{"Ingredient_id": "HBIN001372","Ingredient_name": "14\u03b2,15\u03b2-epoxy-3\u03b1-hydroxy-9-oxo-11(10\u21928)-abeolanost-24-trans-en-26-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC(CCC=C(C)C(=O)O)C1(CC2C3(C1(CCC(=O)C34CCC5C4(CCC(C5(C)C)O)C)C)O2)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7126","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
14β,15β-epoxy-3β-hydroxy-9-oxo-11(10→8)-abeolanosta-24-trans-en-26-oicacid
{"Ingredient_id": "HBIN001374","Ingredient_name": "14\u03b2,15\u03b2-epoxy-3\u03b2-hydroxy-9-oxo-11(10\u21928)-abeolanosta-24-trans-en-26-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC(CCC=C(C)C(=O)O)C1(CC2C3(C1(CCC(=O)C34CCC5C4(CCC(C5(C)C)O)C)C)O2)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7125","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-dehydroxy-23β-hydroxymeliasenin F
{"Ingredient_id": "HBIN001851","Ingredient_name": "16-dehydroxy-23\u03b2-hydroxymeliasenin F","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1(C2CC=C3C(C2(CCC1=O)C)CCC4(C3(CC(C4C5CCC(OC5=O)C(C)(C)O)O)C)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37428","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
16-oxo-3α,21β-dihydroxyserrat-14-en-24-oicacid
{"Ingredient_id": "HBIN001938","Ingredient_name": "16-oxo-3\u03b1,21\u03b2-dihydroxyserrat-14-en-24-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1(C(CCC2(C1C(=O)C=C3C2CCC4C(C3)(CCC5C4(CCC(C5(C)C(=O)O)O)C)C)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16311","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
19,24-dihydroxyurs-12-en-3-one-28-oic acid
{"Ingredient_id": "HBIN002157","Ingredient_name": "19,24-dihydroxyurs-12-en-3-one-28-oic acid","Alias": "19,24-dihydroxyurs-12-en-3-one-28-oicacid","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(=O)C5(C)CO)C)C)C2C1(C)O)C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25867;6176","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
21-o-acetyl toosendantriol
{"Ingredient_id": "HBIN003587","Ingredient_name": "21-o-acetyl toosendantriol","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1(C2CC(C3(C(C2(CCC1=O)C)CCC4(C3=CCC4C5CC(OC5O)C6C(O6)(C)C)C)C)O)C","Ingredient_weight": "486.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14166","TCMID_id": "527","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "100968230","DrugBank_id": "NA"}
2,3,24-trihydroxy-12,27-cyclo-14-taraxeren-28-oic acid; (2α,3α)-form
{"Ingredient_id": "HBIN003823","Ingredient_name": "2,3,24-trihydroxy-12,27-cyclo-14-taraxeren-28-oic acid; (2\u03b1,3\u03b1)-form","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "117581-15-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9002","PubChem_id": "NA","DrugBank_id": "NA"}
24-Hydroxyglycyrrhetic acid
{"Ingredient_id": "HBIN004409","Ingredient_name": "24-Hydroxyglycyrrhetic acid","Alias": "24-hydroxyglycyrrheticacid; (2S,4aS,6bR,10S,12aS,14bR)-10-hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-2-carboxylic acid; AC1NSWIY; 24-hydroxyglycyrrhetic acid","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC12CCC(CC1C3=CC(=O)C4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)CO)O)C)(C)C(=O)O","Ingredient_weight": "486.7 g/mol","OB_score": "24.16796036","CAS_id": "NA","SymMap_id": "SMIT01072","TCMID_id": "31197;10152","TCMSP_id": "MOL004963","TCM_ID_id": "NA","PubChem_id": "101280182","DrugBank_id": "NA"}
26-hydroxy-13-oxaspiroirid-16-enal; 2(7)e-isomer
{"Ingredient_id": "HBIN004952","Ingredient_name": "26-hydroxy-13-oxaspiroirid-16-enal; 2(7)e-isomer","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "280575-66-8","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8730","PubChem_id": "NA","DrugBank_id": "NA"}
28-deacetylbelamcandal
{"Ingredient_id": "HBIN005045","Ingredient_name": "28-deacetylbelamcandal","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC(=CCCC(=C)C=CC=C(CO)C1CCC2(C1O)C(C(=C(C)C=O)CCC2(C)O)CCCO)C","Ingredient_weight": "486.68","OB_score": "22.85756692","CAS_id": "138521-96-7","SymMap_id": "SMIT05773","TCMID_id": "NA","TCMSP_id": "MOL003746","TCM_ID_id": "NA","PubChem_id": "101615676","DrugBank_id": "NA"}
2α, 19α-dihydroxy-3-oxo-12-ursen-28-oic acid
{"Ingredient_id": "HBIN005153","Ingredient_name": "2\u03b1, 19\u03b1-dihydroxy-3-oxo-12-ursen-28-oic acid","Alias": "2\u03b1,19\u03b1-dihydroxy-3-oxo-12-ursen-28-oicacid","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(=O)C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40865;6069","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3α-dihydroxy-19-oxo-18,19-seco-urs-11,13(18)-dien-28-oicacid
{"Ingredient_id": "HBIN005182","Ingredient_name": "2\u03b1,3\u03b1-dihydroxy-19-oxo-18,19-seco-urs-11,13(18)-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6067","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2α,3β,19α-trihydroxy-olean-11,13(18)-dien-28-oicacid
{"Ingredient_id": "HBIN005197","Ingredient_name": "2\u03b1,3\u03b2,19\u03b1-trihydroxy-olean-11,13(18)-dien-28-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21806","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-oxopomolicacid
{"Ingredient_id": "HBIN006287","Ingredient_name": "2-oxopomolicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(=O)C(C5(C)C)O)C)C)C2C1(C)O)C)C(=O)O","Ingredient_weight": "486.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16399","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44593379","DrugBank_id": "NA"}
3-epi-isomasticadienolalicacid
{"Ingredient_id": "HBIN008481","Ingredient_name": "3-epi-isomasticadienolalicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6937","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-hydroxy-12-oleanene-28,30-dioic acid; 3β-form
{"Ingredient_id": "HBIN008612","Ingredient_name": "3-hydroxy-12-oleanene-28,30-dioic acid; 3\u03b2-form","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "18671-48-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8104","PubChem_id": "NA","DrugBank_id": "NA"}
3-hydroxy-3,4-seco-4(24),12-oleanadiene-23,28-dioic acid
{"Ingredient_id": "HBIN008650","Ingredient_name": "3-hydroxy-3,4-seco-4(24),12-oleanadiene-23,28-dioic acid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "96386-63-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "8094","PubChem_id": "NA","DrugBank_id": "NA"}
3-oxo-6β,19α-dihydroxyurs-12-en-28-oicacid
{"Ingredient_id": "HBIN009408","Ingredient_name": "3-oxo-6\u03b2,19\u03b1-dihydroxyurs-12-en-28-oicacid","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CC(C5C4(CCC(=O)C5(C)C)C)O)C)C2C1(C)O)C)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16312","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acerinol
{"Ingredient_id": "HBIN014368","Ingredient_name": "acerinol","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C(C7CCC6(C5)O7)(C)C)C)O2)C(C)(C)O","Ingredient_weight": "486.7 g/mol","OB_score": "29.57331437","CAS_id": "NA","SymMap_id": "SMIT12856","TCMID_id": "NA","TCMSP_id": "MOL012042","TCM_ID_id": "7242","PubChem_id": "101593158","DrugBank_id": "NA"}
acerinol; 24-epimer
{"Ingredient_id": "HBIN014369","Ingredient_name": "acerinol; 24-epimer","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "151061-95-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7241","PubChem_id": "NA","DrugBank_id": "NA"}
acerinol glycoside
{"Ingredient_id": "HBIN014372","Ingredient_name": "acerinol glycoside","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CC2C(OC3(C1C4(CCC5=C(C4(C3O)C)CCC6C57CCC(C6(C)C)OC7)C)O2)C(C)(C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25580","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acerionol
{"Ingredient_id": "HBIN014373","Ingredient_name": "acerionol","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1CC(OC2C1C3(CCC4=C(C3(C2=O)C)CCC5C(C6CCC5(C4)O6)(C)C)C)C(C(C)(C)O)O","Ingredient_weight": "486.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "94","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101593159","DrugBank_id": "NA"}
belachinal
{"Ingredient_id": "HBIN017707","Ingredient_name": "belachinal","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC(=CCCC(=CC=CC(=CC1CC2(C(C(=C(C)C=O)CCC2(C)O)CCCO)C(O1)O)C)C)C","Ingredient_weight": "486.7 g/mol","OB_score": "31.23632983","CAS_id": "NA","SymMap_id": "SMIT05771","TCMID_id": "NA","TCMSP_id": "MOL003743","TCM_ID_id": "NA","PubChem_id": "100933430","DrugBank_id": "NA"}
belamcandal; 2(7)e-isomer,o-de-ac
{"Ingredient_id": "HBIN017710","Ingredient_name": "belamcandal; 2(7)e-isomer,o-de-ac","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "486.68","OB_score": "NA","CAS_id": "280575-70-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6404","PubChem_id": "NA","DrugBank_id": "NA"}
belamcandal; o-de-ac
{"Ingredient_id": "HBIN017711","Ingredient_name": "belamcandal; o-de-ac","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6403","PubChem_id": "NA","DrugBank_id": "NA"}
β-kudinlactone
{"Ingredient_id": "HBIN018171","Ingredient_name": "\u03b2-kudinlactone","Alias": "NA","Ingredient_formula": "C30H46O5","Ingredient_Smile": "CC1(C2CCC3(C(C2(CCC1O)C)CC(C4=C5C(C6(CCC5(CCC43C)C(=O)O6)C)(C)O)O)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "12294","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}