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ergosteryl 3-beta-D-glucoside

MNXM17561 is deprecated and here replaced by MNXM1106968
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM1106968

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	1

formula

C₃₄H₅₄O₆

charge

mass

558.39204

reference

chebi:52973

InChIKey

MKZPNGBJJJZJMI-GBLVNJONSA-N

InChI

InChI=1S/C34H54O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-10,19-21,23,25-32,35-38H,11-18H2,1-6H3/b8-7+/t20-,21+,23-,25+,26-,27-,28+,29+,30-,31+,32+,33-,34+/m0/s1

SMILES

CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC=C4C[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@@]21C

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:52973 chebi:52973	ergosteryl 3-beta-D-glucoside (3beta,22E)-ergosta-5,7,22-trien-3-yl beta-D-glucopyranoside
bigg.metabolite:ergst3glc biggM:ergst3glc	Ergosterol 3 beta D glucoside
sabiork.compound:25270 sabiorkM:25270	Ergosterol 3beta-D-glucoside
metacyc.compound:CPD-11602 metacycM:CPD-11602	ergosterol 3-O-beta-D-glucoside O-glucosyl-ergosterol
seed.compound:cpd16881 seedM:cpd16881	ergosterol 3-beta-D-glucoside ergst3glc
biggM:M_ergst3glc seedM:M_cpd16881	secondary/obsolete/fantasy identifier