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3'-Hydroxyequol

PropertiesImage
MNX_IDMNXM117138 Image of MNXM117138
referencechebi:174381
formulaC15H14O4
global charge0
mol weight258.273
InChIKeyBXUZHRKORIBRMQ-LLVKDONJSA-N
InChIInChI=1S/C15H14O4/c16-12-3-1-10-5-11(8-19-15(10)7-12)9-2-4-13(17)14(18)6-9/h1-4,6-7,11,16-18H,5,8H2/t11-/m1/s1
SMILESOC1=CC2=C(C=C1)C[C@@H](C1=CC(O)=C(O)C=C1)CO2
MNX internals
InChI (mnx)InChI=1/C15H14O4/c16-12-3-1-10-5-11(8-19-15(10)7-12)9-2-4-13(17)14(18)6-9/h1-4,6-7,11,16-18H,5,8H2/t11-/m1/s1 Image of MNXM117138
SMILES (mnx)[CH:1]1=[CH:3][C:12]([OH:16])=[CH:7][C:15]2=[C:10]1[CH2:5][C@@H:11]([C:9]1=[CH:6][C:14]([OH:18])=[C:13]([OH:17])[CH:4]=[CH:2]1)[CH2:8][O:19]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:174381
chebi:174381
BXUZHRKORIBRMQ-LLVKDONJSA-N 		3'-Hydroxyequol
4-[(3S)-7-hydroxy-3,4-dihydro-2H-chromen-3-yl]benzene-1,2-diol
hmdb:HMDB0041652
BXUZHRKORIBRMQ-UHFFFAOYSA-N 		3',4',7-Trihydroxyisoflavan
4-(7-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl)benzene-1,2-diol

CHEBI:174380
chebi:174380
BXUZHRKORIBRMQ-UHFFFAOYSA-N 		3',4',7-Trihydroxyisoflavan
4-(7-hydroxy-3,4-dihydro-2H-chromen-3-yl)benzene-1,2-diol
hmdb:HMDB0041657
BXUZHRKORIBRMQ-LLVKDONJSA-N 		3'-Hydroxyequol
4-[(3S)-7-hydroxy-3,4-dihydro-2H-1-benzopyran-3-yl]benzene-1,2-diol

hmdb:HMDB41652
hmdb:HMDB41657 		secondary/obsolete/fantasy identifier