**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

hederagenin 28-O-beta-D-glucopyranoside

Properties Image Occurences in reactions MNX_ID MNXM55959 #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0 formula C36H58O9 charge 0 mass 634.851 reference chebi:67947 InChIKey WJMMBVSOQPALFO-DLQTVUGOSA-N InChI InChI=1S/C36H58O9/c1-31(2)13-15-36(30(43)45-29-28(42)27(41)26(40)22(18-37)44-29)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(39)33(4,19-38)23(32)9-12-35(24,34)6/h7,21-29,37-42H,8-19H2,1-6H3/t21-,22+,23+,24+,25-,26+,27-,28+,29-,32-,33-,34+,35+,36-/m0/s1 SMILES [CH3:1][C:31]1([CH3:2])[CH2:13][CH2:15][C@:36]2([C:30](=[O:43])[O:45][C@H:29]3[C@H:28]([OH:42])[C@@H:27]([OH:41])[C@H:26]([OH:40])[C@@H:22]([CH2:18][OH:37])[O:44]3)[CH2:16][CH2:14][C@:34]3([CH3:5])[C:20](=[CH:7][CH2:8][C@@H:24]4[C@@:32]5([CH3:3])[CH2:11][CH2:10][C@H:25]([OH:39])[C@@:33]([CH3:4])([CH2:19][OH:38])[C@@H:23]5[CH2:9][CH2:12][C@:35]43[CH3:6])[C@@H:21]2[CH2:17]1

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Similar chemical compounds in external resources

Identifier	Description
CHEBI:67947 chebi:67947	hederagenin 28-O-beta-D-glucopyranoside 1-O-[3beta,23-dihydroxy-28-oxoolean-12-en-28-yl]-beta-D-glucopyranose hederagenin 28-O-beta-D-glucopyranosyl ester
seed.compound:cpd25705 seedM:cpd25705	28-Glc-hederagenin hederagenin-28-O-B-glucoside hederagenin-28-O-beta-D-glucoside hederagenin-28-O-beta-glucoside
metacyc.compound:CPD-9488 metacycM:CPD-9488	hederagenin-28-O-beta-D-glucoside 28-Glc-hederagenin hederagenin-28-O-B-glucoside
seedM:M_cpd25705	secondary/obsolete/fantasy identifier