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oleuropein (aldehyde form)

PropertiesImage
MNX_IDMNXM107389 Image of MNXM107389
referencechebi:68989
formulaC19H22O8
global charge0
mol weight378.377
InChIKeyXJKRAZDUJSUQBC-UHFFFAOYSA-N
InChIInChI=1S/C19H22O8/c1-11-15(9-20)14(18(10-26-11)27-12(2)21)8-19(24)25-6-5-13-3-4-16(22)17(23)7-13/h3-4,7,9-11,14-15,22-23H,5-6,8H2,1-2H3
SMILESCC(=O)OC1=COC(C)C(C=O)C1CC(=O)OCCC1=CC(O)=C(O)C=C1
MNX internals
InChI (mnx)InChI=1/C19H22O8/c1-11-15(9-20)14(18(10-26-11)27-12(2)21)8-19(24)25-6-5-13-3-4-16(22)17(23)7-13/h3-4,7,9-11,14-15,22-23H,5-6,8H2,1-2H3/t11?,14?,15? Image of MNXM107389
SMILES (mnx)[CH3:1][CH:11]1[CH:15]([CH:9]=[O:20])[CH:14]([CH2:8][C:19](=[O:24])[O:25][CH2:6][CH2:5][C:13]2=[CH:7][C:17]([OH:23])=[C:16]([OH:22])[CH:4]=[CH:3]2)[C:18]([O:27][C:12]([CH3:2])=[O:21])=[CH:10][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:68989
chebi:68989
XJKRAZDUJSUQBC-UHFFFAOYSA-N
oleuropein (aldehyde form)