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(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan

PropertiesImagewith InChI numberingOccurences in reactions
MNX_IDMNXM1510 Image of MNXM1510 Image of MNXM1510
#reac
in my sandbox 0
in MNXref (generic)14
in models (compartimentalized) 1
formulaC20H20O5
charge0
mass340.375
referencechebi:50118
InChIKeyTUXXPRXOVFCNPC-VQTJNVASSA-N
InChIInChI=1S/C20H20O5/c1-11(2)3-4-12-7-14-17(9-16(12)22)24-10-20(23)15-6-5-13(21)8-18(15)25-19(14)20/h3,5-9,19,21-23H,4,10H2,1-2H3/t19-,20+/m0/s1
SMILES[CH3:1][C:11]([CH3:2])=[CH:3][CH2:4][c:12]1[cH:7][c:14]2[c:17]([cH:9][c:16]1[OH:22])[O:24][CH2:10][C@@:20]1([OH:23])[c:15]3[cH:6][cH:5][c:13]([OH:21])[cH:8][c:18]3[O:25][C@@H:19]21
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Similar chemical compounds in external resources
IdentifierDescription
CHEBI:50118
chebi:50118 		(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
(+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
(6aS,11aS)-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,6a,9(11aH)-triol
2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
2-dimethylallylglycinol
Glyceocarpin
pterocarpan glyceocarpin
lipidmaps:LMPK12070004
lipidmapsM:LMPK12070004 		(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
(6aS,11aS)-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,6a,9(11aH)-triol
2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
2-dimethylallylglycinol
Glyceocarpin
metacyc.compound:CPD-4404
metacycM:CPD-4404 		(6alphaS,11alphaS)-3,6a,9-trihydroxy-2-prenylpterocarpan
(+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
(6alphaS,11alphaS)-2-dimethylallyl-3,6alpha,9-trihydroxypterocarpan
2-(6alphaS,11alphaS)-dimethylallyl-3,6alpha,9-trihydroxypterocarpan
2-dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
Glyceocarpin
seed.compound:cpd11189
seedM:cpd11189 		Glyceocarpin
(+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
(6alphaS,11alphaS)-2-dimethylallyl-3,6alpha,9-trihydroxypterocarpan
2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
2-dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
kegg.compound:C15509
keggC:C15509 		Glyceocarpin
(6aS,11aS)-3,6a,9-Trihydroxy-2-prenylpterocarpan
2-Dimethylallyl-(6aS,11aS)-3,6a,9-trihydroxypterocarpan
hmdb:HMDB0037916 Glyceollidin II
2-(3-Methyl-2-butenyl)-6H-benzofuro[3,2-c][1]benzopyran-3,6a,9(11ah)-triol, 9ci
4-(3-methylbut-2-en-1-yl)-8,17-dioxatetracyclo[8.7.0.0²,⁷.0¹¹,¹⁶]heptadeca-2(7),3,5,11(16),12,14-hexaene-5,10,14-triol
Glyceocarpin
CHEBI:174573
chebi:174573 		Glyceollidin II
2-(3-methylbut-2-enyl)-6,11a-dihydro-[1]benzouro[3,2-c]chromene-3,6a,9-triol
hmdb:HMDB37916
keggC:M_C15509
seedM:M_cpd11189 		secondary/obsolete/fantasy identifier