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6-Hydroxyenterolactone

PropertiesImage
MNX_IDMNXM118433 Image of MNXM118433
referencechebi:175039
formulaC18H18O5
global charge0
mol weight314.337
InChIKeyZMNWDZAVQFERIQ-XJKSGUPXSA-N
InChIInChI=1S/C18H18O5/c19-14-3-1-2-11(7-14)6-13-10-23-18(22)16(13)9-12-8-15(20)4-5-17(12)21/h1-5,7-8,13,16,19-21H,6,9-10H2/t13-,16+/m0/s1
SMILESO=C1OC[C@H](CC2=CC(O)=CC=C2)[C@H]1CC1=C(O)C=CC(O)=C1
MNX internals
InChI (mnx)InChI=1/C18H18O5/c19-14-3-1-2-11(7-14)6-13-10-23-18(22)16(13)9-12-8-15(20)4-5-17(12)21/h1-5,7-8,13,16,19-21H,6,9-10H2/t13-,16+/m0/s1 Image of MNXM118433
SMILES (mnx)[CH:1]1=[CH:2][C:11]([CH2:6][C@H:13]2[CH2:10][O:23][C:18](=[O:22])[C@@H:16]2[CH2:9][C:12]2=[C:17]([OH:21])[CH:5]=[CH:4][C:15]([OH:20])=[CH:8]2)=[CH:7][C:14]([OH:19])=[CH:3]1
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

hmdb:HMDB0041700
CHEBI:175039
chebi:175039
ZMNWDZAVQFERIQ-XJKSGUPXSA-N
6-Hydroxyenterolactone
(3R,4R)-3-[(2,5-dihydroxyphenyl)methyl]-4-[(3-hydroxyphenyl)methyl]oxolan-2-one

hmdb:HMDB41700
secondary/obsolete/fantasy identifier