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steviolmonoside

MNXM97342 is deprecated and replaced by MNXM819938
PropertiesImage
MNX_IDMNXM819938 Image of MNXM819938
referencechebi:145010
formulaC26H39O8
global charge-1
mol weight479.59
InChIKeyQSIDJGUAAUSPMG-CULFPKEHSA-M
InChIInChI=1S/C26H40O8/c1-14-11-25-9-5-16-23(2,7-4-8-24(16,3)22(31)32)17(25)6-10-26(14,13-25)34-21-20(30)19(29)18(28)15(12-27)33-21/h15-21,27-30H,1,4-13H2,2-3H3,(H,31,32)/p-1/t15-,16+,17+,18-,19+,20-,21+,23-,24-,25-,26+/m1/s1
SMILESC=C1C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C(=O)[O-])[C@@H]2CC[C@]1(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C3
MNX internals
InChI (mnx)InChI=1/C26H40O8/c1-14-11-25-9-5-16-23(2,7-4-8-24(16,3)22(31)32)17(25)6-10-26(14,13-25)34-21-20(30)19(29)18(28)15(12-27)33-21/h15-21,27-30H,1,4-13H2,2-3H3,(H,31,32)/t15-,16+,17+,18-,19+,20-,21+,23-,24-,25-,26+/m1/s1 Image of MNXM819938
SMILES (mnx)[CH2:1]=[C:14]1[CH2:11][C@@:25]23[CH2:9][CH2:5][C@H:16]4[C@@:23]([CH3:2])([CH2:7][CH2:4][CH2:8][C@@:24]4([CH3:3])[C:22](=[O:31])[OH:32])[C@@H:17]2[CH2:6][CH2:10][C@:26]1([O:34][C@H:21]1[C@H:20]([OH:30])[C@@H:19]([OH:29])[C@H:18]([OH:28])[C@@H:15]([CH2:12][OH:27])[O:33]1)[CH2:13]3
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:145010
chebi:145010
QSIDJGUAAUSPMG-CULFPKEHSA-M 		steviolmonoside
steviolmonoside(1-)

seed.compound:cpd34317
seedM:cpd34317
QSIDJGUAAUSPMG-CULFPKEHSA-M 		19-O-beta-D-glucopyranosyl steviol
glucosilsteviol
steviolmonoside

CHEBI:145029
chebi:145029
QSIDJGUAAUSPMG-CULFPKEHSA-N 		steviolmonoside
13-O-beta-D-glucopyranosyl steviol
13alpha-(beta-D-glucopyranosyloxy)-5beta,8alpha,9beta,10alpha-kaur-16-en-18-oic acid
glucosilsteviol
steviol-13-O-D-glucopyranoside

metacyc.compound:CPD-14502
metacycM:CPD-14502
QSIDJGUAAUSPMG-CULFPKEHSA-M 		steviolmonoside
19-O-beta-D-glucopyranosyl steviol
glucosilsteviol

seedM:M_cpd34317 		secondary/obsolete/fantasy identifier