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alpha-D-Glucopyranosyl 2-O-stearoyl-alpha-D-glucopyranoside

PropertiesImage
MNX_IDMNXM166015 Image of MNXM166015
referencechebi:177503
formulaC30H56O12
global charge0
mol weight608.766
InChIKeyGFRMFYYRVUPPGY-VEFFTAHGSA-N
InChIInChI=1S/C30H56O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)41-28-26(37)24(35)21(19-32)40-30(28)42-29-27(38)25(36)23(34)20(18-31)39-29/h20-21,23-32,34-38H,2-19H2,1H3/t20-,21-,23-,24-,25+,26+,27-,28-,29-,30-/m1/s1
SMILESCCCCCCCCCCCCCCCCCC(=O)O[C@H]1[C@@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)O[C@H](CO)[C@@H](O)[C@@H]1O
MNX internals
InChI (mnx)InChI=1/C30H56O12/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(33)41-28-26(37)24(35)21(19-32)40-30(28)42-29-27(38)25(36)23(34)20(18-31)39-29/h20-21,23-32,34-38H,2-19H2,1H3/t20-,21-,23-,24-,25+,26+,27-,28-,29-,30-/m1/s1 Image of MNXM166015
SMILES (mnx)[CH3:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][C:22](=[O:33])[O:41][C@@H:28]1[C@@H:26]([OH:37])[C@H:24]([OH:35])[C@@H:21]([CH2:19][OH:32])[O:40][C@@H:30]1[O:42][C@@H:29]1[C@H:27]([OH:38])[C@@H:25]([OH:36])[C@H:23]([OH:34])[C@@H:20]([CH2:18][OH:31])[O:39]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:177503
chebi:177503
GFRMFYYRVUPPGY-VEFFTAHGSA-N
alpha-D-Glucopyranosyl 2-O-stearoyl-alpha-D-glucopyranoside
[(2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl] octadecanoate

metacyc.compound:CPD-18703
metacycM:CPD-18703
seed.compound:cpd32538
seedM:cpd32538
GFRMFYYRVUPPGY-VEFFTAHGSA-N
2-stearoyl-trehalose
trehalose-2-stearate

seedM:M_cpd32538
secondary/obsolete/fantasy identifier