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6-Epi-7-isocucurbic acid glucoside

PropertiesImage
MNX_IDMNXM118395 Image of MNXM118395
referencechebi:168143
formulaC18H30O8
global charge0
mol weight374.43
InChIKeyGJZJZRWFRZFTEE-ONEGZZNKSA-N
InChIInChI=1S/C18H30O8/c1-2-3-4-5-11-10(8-14(20)21)6-7-12(11)25-18-17(24)16(23)15(22)13(9-19)26-18/h3-4,10-13,15-19,22-24H,2,5-9H2,1H3,(H,20,21)/b4-3+
SMILESCC/C=C/CC1C(CC(=O)O)CCC1OC1OC(CO)C(O)C(O)C1O
MNX internals
InChI (mnx)InChI=1/C18H30O8/c1-2-3-4-5-11-10(8-14(20)21)6-7-12(11)25-18-17(24)16(23)15(22)13(9-19)26-18/h3-4,10-13,15-19,22-24H,2,5-9H2,1H3,(H,20,21)/b4-3+/t10?,11?,12?,13?,15?,16?,17?,18? Image of MNXM118395
SMILES (mnx)[CH3:1][CH2:2]/[CH:3]=[CH:4]/[CH2:5][CH:11]1[CH:10]([CH2:8][C:14](=[O:20])[OH:21])[CH2:6][CH2:7][CH:12]1[O:25][CH:18]1[CH:17]([OH:24])[CH:16]([OH:23])[CH:15]([OH:22])[CH:13]([CH2:9][OH:19])[O:26]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:168143
chebi:168143
GJZJZRWFRZFTEE-ONEGZZNKSA-N 		6-Epi-7-isocucurbic acid glucoside
2-[2-[(E)-pent-2-enyl]-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopentyl]acetic acid
hmdb:HMDB0029782
GJZJZRWFRZFTEE-ONEGZZNKSA-N 		6-Epi-7-isocucurbic acid glucoside
2-{2-[(2E)-pent-2-en-1-yl]-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclopentyl}acetate
2-{2-[(2E)-pent-2-en-1-yl]-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclopentyl}acetic acid
6-Epi-7-isocucurbate glucoside
{2-[(2E)-pent-2-en-1-yl]-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclopentyl}acetic acid

hmdb:HMDB29782 		secondary/obsolete/fantasy identifier