Search MNXref
 Feedback

11,13-dimethoxy-12-hydroxy-9-octadecenoic acid

PropertiesImage
MNX_IDMNXM22962 Image of MNXM22962
referencechebi:169478
formulaC20H38O5
global charge0
mol weight358.519
InChIKeyMQWZCHDMBWJFTK-NTCAYCPXSA-N
InChIInChI=1S/C20H38O5/c1-4-5-11-14-17(24-2)20(23)18(25-3)15-12-9-7-6-8-10-13-16-19(21)22/h12,15,17-18,20,23H,4-11,13-14,16H2,1-3H3,(H,21,22)/b15-12+
SMILESCCCCCC(OC)C(O)C(/C=C/CCCCCCCC(=O)O)OC
MNX internals
InChI (mnx)InChI=1/C20H38O5/c1-4-5-11-14-17(24-2)20(23)18(25-3)15-12-9-7-6-8-10-13-16-19(21)22/h12,15,17-18,20,23H,4-11,13-14,16H2,1-3H3,(H,21,22)/b15-12+/t17?,18?,20? Image of MNXM22962
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:11][CH2:14][CH:17]([CH:20]([CH:18](/[CH:15]=[CH:12]/[CH2:9][CH2:7][CH2:6][CH2:8][CH2:10][CH2:13][CH2:16][C:19](=[O:21])[OH:22])[O:25][CH3:3])[OH:23])[O:24][CH3:2]
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:169478
chebi:169478
MQWZCHDMBWJFTK-NTCAYCPXSA-N 		11,13-dimethoxy-12-hydroxy-9-octadecenoic acid
(E)-12-hydroxy-11,13-dimethoxyoctadec-9-enoic acid

lipidmaps:LMFA01080003
lipidmapsM:LMFA01080003
MQWZCHDMBWJFTK-NTCAYCPXSA-N 		11,13-dimethoxy-12-hydroxy-9-octadecenoic acid
11,13-dimethoxy-12-hydroxy-9-octadecenoic acid
FA 20:1
O3