Exact Mass: 326.1604
Exact Mass Matches: 326.1604
Found 392 metabolites which its exact mass value is equals to given mass value 326.1604
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
LICARIN A
(-)-Licarin A is a natural product found in Magnolia dodecapetala, Magnolia kachirachirai, and other organisms with data available. Dehydrodiisoeugenol is a natural product found in Myristica fragrans with data available. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Licarin A ((+)-Licarin A), a neolignan, significantly and dose-dependently reduces TNF-α production (IC50=12.6 μM) in dinitrophenyl-human serum albumin (DNP-HSA)-stimulated RBL-2H3 cells. Anti-allergic effects. Licarin A reduces TNF-α and PGD2 production, and COX-2 expression[1]. Licarin A ((+)-Licarin A), a neolignan, significantly and dose-dependently reduces TNF-α production (IC50=12.6 μM) in dinitrophenyl-human serum albumin (DNP-HSA)-stimulated RBL-2H3 cells. Anti-allergic effects. Licarin A reduces TNF-α and PGD2 production, and COX-2 expression[1].
5,5-Diisopropyl-2,2'-dimethylbiphenyl-3,3',4,4'-tetrone
5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is found in herbs and spices. 5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is a constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. Constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. 5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is found in herbs and spices.
Gingerenone C
Constituent of Zingiber officinale (ginger). Gingerenone C is found in herbs and spices and ginger. Gingerenone C is found in ginger. Gingerenone C is a constituent of Zingiber officinale (ginger)
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is found in herbs and spices. 1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is from Alpinia officinarum (lesser galangal). From Alpinia officinarum (lesser galangal). 1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is found in herbs and spices.
Alkaloid AQC2
Alkaloid AQC2 is an alkaloid AQC2 is an alkaloid from cell cultures of Aspidosperma quebracho-blanco (quebracho)
(+)-Galeon
(-)-Galeon is found in herbs and spices. (-)-Galeon is a constituent of Myrica gale (bog myrtle)
1,2-Dihydrodehydroguaiaretic acid
1,2-Dihydrodehydroguaiaretic acid is found in herbs and spices. 1,2-Dihydrodehydroguaiaretic acid is a constituent of Myristica fragrans (nutmeg). Constituent of Myristica fragrans (nutmeg). 1,2-Dihydrodehydroguaiaretic acid is found in herbs and spices.
Dehydrodiisoeugenol
Gelsenicine
Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2]. Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2].
Hydrodolasetron
Poncitrin
Poncitrin is a member of the class of compounds known as linear pyranocoumarins. Linear pyranocoumarins are organic compounds containing a pyran (or a hydrogenated derivative) linearly fused to a coumarin moiety. Poncitrin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Poncitrin can be found in sweet orange, which makes poncitrin a potential biomarker for the consumption of this food product.
Humantenmine
Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2]. Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2].
Dehydrodiisoeugenol
Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2].
2-Carboxy-3,5-dihydroxy-4-(3-methyl-2-butenyl)bibenzyl
Acutifolin A
Broussinol
4-[(2R,3R)-2,3-dihydro-7-methoxy-3-methyl-5-(prop-2-enyl)benzofuran-2-yl]-2-methoxyphenol|isodihydrocarinatidin
Triptonolide
A tetracyclic diterpenoid with formula C20H22O4, originally isolated from Tripterygium wilfordii.
2-Phenyl-4--6-methyl-7(?)-hydroxy-2,3-dihydro-1,4-benzoxazin-3-on|2-Phenyl-4--6-methyl-7-hydroxy-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-7-hydroxy-6-methyl-2-phenyl-4H-benzo[1,4]oxazin-3-one
Rac-(2S,3S)-5-allyl-6-hydroxy-2-(3,4-dimethoxyphenyl)-3-methyl-2,3-dihydrobenzofuran
7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3,5-heptadione|7-(4-hydroxy-3methoxyphenyl)-1-phenyl-3,5-heptadione
(4E,6R)-6-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylhept-4-en-3-one|alpinoid B
8-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,7-dihydroxynaphthalene-1,4-dione
(Z)-10-hydroxy-N(alpha)-demethyl-19,20-dehydroraumacline
1,7,8,12b-tetrahydro-2,2,4-trimethyl-2h-benzo[6,7]cyclohepta[1,2,3-de][1]benzopyran-5,10,11-triol
1,3-dihydroxy-3-methyl-3-methyl-3-prenyl-2,3-dihydronaphto[1,2-b]oxepin-4(1H)-one|aggregatin D
1-(4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
(9S)-3(?),9-Dihydroxy-1H-cinchonan-2-on|(9S)-3(?),9-dihydroxy-1H-cinchonan-2-one
3-Geranyl-4-hydroxy-5-cumarincarbaldehyd|Piloselloidal
4-[(2S)-3,4-dihydro-7-hydroxy-8-(3-methyl-2-buten-1-yl)-2H-1-benzopyran-2-yl]-1,3-benzenediol|Anticancer Flavonoid PMV70P691-013|morusyunnansin F
(3S)-Methoxy-1,7-bis(4-hydroxyphenyl)-6E-hepten-5-one
(7alpha,8beta)-4,4-dihydroxy-3,3-dimethoxy-6,7-cyclolign-7-ene|(7R,8S)-4,5-dihydroxy-8,8-dimethyl-3,4-dimethoxy-2,7-cyclolignan-7-ene
4-[(E,3S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(4-hydroxyphenyl)prop-1-enyl]phenol
3-Ethyl-11-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
2,4,5-trihydroxy-3-methoxy-4-(gamma,gamma-dimethylallyl)stilbene|artolacuchin
(E)-4-(3-methyl-2-buten-1-yl)-3,3,5-trihydroxy-4-methoxystilbene
3,5,3-trihydroxy-4-methoxy-5-isopent-2-enylstilbene|MIP
(E)-3-(3-methyl-2-butenyloxy)-4,5-dihydroxy-3-methoxystilbene|E-1-[5-hydroxy-3-(3-methylbut-2-enyloxy)phenyl]-2-[4-hydroxy-3-methoxyphenyl]ethene
(E)-2-(3-methyl-2-buten-1-yl)-3,4,5-trihydroxy-3-methoxystilbene
3-Ethyl-3-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
4,4-diallyl-5,5-dimethoxy-[1,1-biphenyl]-2,2-diol|biseugenol A
3-Ethyl-5-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
5-hydroxy-2,8,8-trimethyl-6-(3-methyl-but-2-enyl)-8H-pyrano[2,3-f]chromen-4-one|6-(3,3-dimethylallyl)alloptaeroxylin|6-(3-methylbut-2-enyl)allopteroxylin
1-(3-Methyl-2-butenyl)-2-(4-hydroxyphenyl)-5-hydroxybicyclo[3.3.1]nona-6-ene-8,9-dione
2H,8H-Benzo[1,2-b:5,4-b]dipyran-2-one, 5-methoxy-8,8-dimethyl-10-(3-methyl-2-butenyl)-
10-(4-hydroxy-4-methylpent-2-enoyl)-13-isopropyl-5-methyl-[1,2]naphthoquinone|8-[(2E)-4-hydroxy-4-methyl-1-oxopent-2-en-1-yl]-7-methyl-3-(1-methylethyl)naphthalen-1,2-dione|prionoid E
7-(3,7-dimethylocta-2,5,7-trienyloxy)-8-methoxycoumarin|schinitrienin
(3R)-3,5-dihydroxy-4-methoxy-3,4-oxo-1,7-diphenyl-1-heptene
2-<4(?)-Hydroxyphenyl>-4--6-methyl-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-2-(4-hydroxy-phenyl)-6-methyl-4H-benzo[1,4]oxazin-3-one
2-Phenyl-4--6-hydroxymethyl-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-6-hydroxymethyl-2-phenyl-4H-benzo[1,4]oxazin-3-one
Phenol, 2-methoxy-6-(2-methoxy-4-(2-propenyl)phenoxy)-4-(2-propenyl)-
dimoxystrobin
CONFIDENCE standard compound; INTERNAL_ID 2597 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3598
1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
4-[(3S)-7-hydroxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-3-yl]benzene-1,3-diol
NPE_327.1704_12.2
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1102
C20H22O4_2-Methoxy-4-{(2S,3R)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol
Gly Gly Pro Pro
Gly Pro Gly Pro
Gly Pro Pro Gly
Pro Gly Gly Pro
Pro Gly Pro Gly
Pro Pro Gly Gly
1H-Indole-3-carboxylic acid, octahydro-3-hydroxy-2,6-methano-2H-quinolizin-8-yl ester, N-oxide
(+)-galeon
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione
Alkaloid AQC2
5,5-Diisopropyl-2,2'-dimethylbiphenyl-3,3',4,4'-tetrone
4-Allyl-2-[1-(1,3-benzodioxol-5-yl)-2-propanyl]-6-methoxyphenol
1-[2-AMINO-1-(3-PHENOXY-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLICACID
1-{2-(Cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}ethanone
1H-Pyrrolo[2,3-b]pyridine, 1-[(1,1-dimethylethyl)dimethylsilyl]-5-(3-fluorophenyl)-
1-(((TERT-BUTYLDIPHENYLSILYL)OXY)METHYL)CYCLOPROPANOL
Bumadizone
M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents
(1R,4R)-[4-(6-Chloro-pyriMidin-4-ylaMino)-cyclohexyl]-carbaMic acid tert-butyl ester
2-ETHYL-4-(4-METHYLPIPERAZIN-1-YL)-10H-BENZO[B]THIENO[2,3-E][1,4]DIAZEPINE
Agatharesinol acetonide
A natural product found in Metasequoia glyptostroboides.
4-([2-(1H-INDOL-3-YL)-ETHYLAMINO]-METHYL)-2,6-DIMETHOXY-PHENOL
6-(cyclohexylsulfanyl)-1-(ethoxymethyl)-5-(1-methylethyl)pyrimidine-2,4(1H,3H)-dione
(3bR,9bS)-6-hydroxy-9b-methyl-7-(propan-2-yl)-3,3b,4,9b,10,11-hexahydrophenanthro[1,2-c]furan-1,5-dione
Benzeneacetamide, 2-((2,5-dimethylphenoxy)methyl)-alpha-(methoxyimino)-N-methyl-
Methacrylic acid 2-hydroxy-3-(4-anilinoanilino)propyl ester
VALTORCITABINE
C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
(3aS,4R,9bR)-4-(4-hydroxyphenyl)-6-(methoxymethyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen-8-ol
2,6-Dimethyl-1-(3-[3-methyl-5-isoxazolyl]-propanyl)-4-[2-methyl-4-isoxazolyl]-phenol
4-{Methyl[3-phenyl-3-(pyridin-2-yl)propyl]amino}-4-oxobutanoic acid
[3-carboxy-2-[(3E,5E,7E)-8-carboxyocta-3,5,7-trienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(2E,4E,7E)-8-carboxyocta-2,4,7-trienoyl]oxypropyl]-trimethylazanium
nor-6,7-secoangustilobine A, (rel)-
A natural product found in Alstonia spatulata.
4-(4-methoxyphenyl)-N-[(E)-(2-methoxyphenyl)methylidene]butanehydrazide
N-[2-(1-cyclohexenyl)ethyl]-3-(1,3-dioxo-2-isoindolyl)propanamide
N-[(3-methylphenyl)methyl]-6-(3-pyridinyl)-4-quinazolinamine
6-(3-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazolinamine
1-[2,4-Dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone
1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-(4E)-4-hepten-3-one
A diarylheptanoid that is (4E)-4-hepten-3-one substituted by a 4-hydroxy-3-methoxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 respectively. It has been isolated from the rhizomes of Curcuma kwangsiensis.
1-(4-hydroxy-3-methoxyphenyl)-7-phenylheptane-3,5-dione
Crocetin(2-)
A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxy groups of crocetin. The major species at pH 7.3.
(9r)-17,19-dioxatetracyclo[12.6.1.1²,⁶.0¹⁶,²⁰]docosa-1(21),2(22),3,5,14,16(20)-hexaene-3,9-diol
7-methoxy-11,11-dimethyl-5h,10h,10ah-benzo[b]fluorene-4b,5,9-triol
8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2,7-dihydroxynaphthalene-1,4-dione
6-methoxy-3-(6-methoxy-3,4-dihydro-2h-1-benzopyran-3-yl)-3,4-dihydro-2h-1-benzopyran
3-ethyl-11-hydroxy-5-oxa-8,18-diazapentacyclo[9.7.1.1³,⁸.0⁴,⁶.0¹²,¹⁷]icosa-1(18),12,14,16-tetraen-19-one
4-{6,7-dimethyl-2h,5h,6h,7h,8h-naphtho[2,3-d][1,3]dioxol-5-yl}-2-methoxyphenol
5-methyl-4-{2-[(3z,5r)-5-(2-methylprop-1-en-1-yl)oxolan-3-ylidene]ethoxy}chromen-2-one
(12r,19s)-12-ethyl-9,19-dihydroxy-8,16-diazatetracyclo[10.6.1.0²,⁷.0¹⁶,¹⁹]nonadeca-1(18),2,4,6,8-pentaen-17-one
10-hydroxy-2-isopropyl-3-methoxy-8,8-dimethyl-7h-phenanthrene-1,9-dione
7-ethyl-3,8,9-trihydroxy-2,4,4,6-tetramethylanthracen-1-one
8-methoxy-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9,16-tetraen-14-ol
(4e,6r)-6-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylhept-4-en-3-one
(1r)-13,16,16-trimethyl-15-oxatetracyclo[8.7.1.0²,⁷.0¹⁴,¹⁸]octadeca-2,4,6,10,12,14(18)-hexaene-5,6,12-triol
(6z,9z)-10-[(1r,3r,4r,6r,7s)-6-chloro-3-ethyl-2-oxabicyclo[2.2.1]heptan-7-yl]deca-6,9-dienoic acid
4-[(3s)-3-[(4s)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(4-hydroxyphenyl)prop-1-en-1-yl]phenol
10-{6-chloro-3-ethyl-2-oxabicyclo[2.2.1]heptan-7-yl}deca-6,9-dienoic acid
(2r,3s,4r,5r,6s)-2-{[(2r,3r,4r)-2,6-dihydroxy-4-methoxyhexan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(6r,7s,8s)-8-(2h-1,3-benzodioxol-5-yl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
4-[(3s)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]-6-(2-methylbut-3-en-2-yl)benzene-1,3-diol
(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl (2e,6z)-deca-2,6-dien-4-ynoate
4-(7-hydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)-3-(3-methylbut-2-en-1-yl)benzene-1,2-diol
(1s,12as,13r,14r,15ar)-14-chloro-1-ethyl-13-hydroxy-1h,4h,5h,6h,7h,10h,12ah,13h,14h,15h,15ah-cyclopenta[c]oxacyclotetradecan-3-one
(4br,5r,9ar,10as)-5,9a-dihydroxy-7-methoxy-11,11-dimethyl-4bh,5h,10h,10ah-cyclohexa[b]fluoren-9-one
3-hydroxy-5-[(1z)-3-hydroxy-4-methylpenta-1,3-dien-1-yl]-2-isopropyl-6-methylnaphthalene-1,4-dione
19,21-dioxa-2,12-diazaheptacyclo[10.9.1.1¹⁶,²⁰.0¹,⁹.0²,¹⁸.0³,⁸.0¹⁶,²²]tricosa-3,5,7-trien-9-ol
(2s,3s)-2-(3,4-dimethoxyphenyl)-3-methyl-5-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-ol
(1s)-13,16,16-trimethyl-15-oxatetracyclo[8.7.1.0²,⁷.0¹⁴,¹⁸]octadeca-2,4,6,10,12,14(18)-hexaene-4,5,12-triol
4-[(2r)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]-3-(3-methylbut-2-en-1-yl)benzene-1,2-diol
15-ethyl-4-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.0⁴,¹².0⁵,¹⁰.0¹⁶,¹⁸]icosa-5,7,9,11-tetraen-13-one
3,3’-bis(6-methoxychroman)
{"Ingredient_id": "HBIN007157","Ingredient_name": "3,3\u2019-bis(6-methoxychroman)","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "COC1=CC2=C(C=C1)OCC(C2)C3CC4=C(C=CC(=C4)OC)OC3","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2481","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(3s)-methoxy-1,7-bis(4-hydroxyphenyl)-6 e-hepten-5-one
{"Ingredient_id": "HBIN009724","Ingredient_name": "(3s)-methoxy-1,7-bis(4-hydroxyphenyl)-6 e-hepten-5-one","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "COC(CCC1=CC=C(C=C1)O)CC(=O)C=CC2=CC=C(C=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13852","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,8-dihydroxy-2h-1-benzopyran-2-one; 7-o-(3,7-dimethyl-2,5,7-octatrienyl),8-me ether
{"Ingredient_id": "HBIN012973","Ingredient_name": "7,8-dihydroxy-2h-1-benzopyran-2-one; 7-o-(3,7-dimethyl-2,5,7-octatrienyl),8-me ether","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7485","PubChem_id": "NA","DrugBank_id": "NA"}
7-hydroxy-12-methoxy-20-nor-abieta-1,5(10),7,9,12-pentaen-6,14-dione
{"Ingredient_id": "HBIN013200","Ingredient_name": "7-hydroxy-12-methoxy-20-nor-abieta-1,5(10),7,9,12-pentaen-6,14-dione","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10428","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajuforrestine b
{"Ingredient_id": "HBIN014960","Ingredient_name": "ajuforrestine b","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "CC1COC2=C(C3=C(C(=O)C=C4C3(CCC(=C4C)C)C)C(=C12)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "787","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
anticancer flavonoid pmv70p691-013
{"Ingredient_id": "HBIN016322","Ingredient_name": "anticancer flavonoid pmv70p691-013","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "CC(=CCC1=C(C=CC2=C1OC(CC2)C3=C(C=C(C=C3)O)O)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1397","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
austrobailignan-5
{"Ingredient_id": "HBIN017382","Ingredient_name": "austrobailignan-5","Alias": "NA","Ingredient_formula": "C20H22O4","Ingredient_Smile": "CC(CC1=CC2=C(C=C1)OCO2)C(C)CC3=CC4=C(C=C3)OCO4","Ingredient_weight": "326.39","OB_score": "42.54318497","CAS_id": "55890-23-8","SymMap_id": "SMIT09324","TCMID_id": "NA","TCMSP_id": "MOL007985","TCM_ID_id": "NA","PubChem_id": "185825","DrugBank_id": "NA"}