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3-O-beta-D-glucosyl-D-glucuronate

PropertiesImage
MNX_IDMNXM150989 Image of MNXM150989
referencechebi:76826
formulaC12H19O12
global charge-1
mol weight355.272
InChIKeyFZIWWMBARQNGJH-YEOGOCOXSA-M
InChIInChI=1S/C12H20O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h1,3-10,12,14-20H,2H2,(H,21,22)/p-1/t3-,4+,5+,6-,7+,8-,9+,10+,12-/m0/s1
SMILESO=C[C@H](O)[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C12H20O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h1,3-10,12,14-20H,2H2,(H,21,22)/t3-,4+,5+,6-,7+,8-,9+,10+,12-/m0/s1 Image of MNXM150989
SMILES (mnx)[CH:1]([C@@H:3]([C@H:10]([C@@H:7]([C@@H:8]([C:11](=[O:21])[OH:22])[OH:19])[OH:18])[O:24][C@H:12]1[C@H:9]([OH:20])[C@@H:6]([OH:17])[C@H:5]([OH:16])[C@@H:4]([CH2:2][OH:14])[O:23]1)[OH:15])=[O:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:76826
chebi:76826
FZIWWMBARQNGJH-YEOGOCOXSA-M 		3-O-beta-D-glucosyl-D-glucuronate
3-O-beta-D-glucopyranosyl-D-glucuronate
beta-D-glucopyranosyl-(1->3)-D-glucuronate
beta-D-glucosyl-(1->3)-D-glucuronate

sabiork.compound:29867
sabiorkM:29867
FZIWWMBARQNGJH-YEOGOCOXSA-N 		3-O-beta-D-Glucopyranosyl-D-glucuronic acid

CHEBI:77025
chebi:77025
FZIWWMBARQNGJH-YEOGOCOXSA-N 		3-O-beta-D-glucosyl-D-glucuronic acid
3-O-beta-D-glucopyranosyl-D-glucuronic acid
beta-D-glucopyranosyl-(1->3)-D-glucuronic acid
beta-D-glucosyl-(1->3)-D-glucuronic acid