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1-O-(hexadec-1-enyl)-2-O-octadeca-9,12-dienoyl-sn-glycero-3-phosphoethanolamine

PropertiesImage
MNX_IDMNXM32918 Image of MNXM32918
referencechebi:59478
formulaC39H74NO7P
global charge0
mol weight699.995
InChIKeyLJVXDBWIBQQKFU-YTHBNWPCSA-N
InChIInChI=1S/C39H74NO7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-39(41)47-38(37-46-48(42,43)45-35-33-40)36-44-34-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,31,34,38H,3-10,12,14-16,18,20-30,32-33,35-37,40H2,1-2H3,(H,42,43)/b13-11+,19-17+,34-31+/t38-/m1/s1
SMILESCCCCC/C=C/C/C=C/CCCCCCCC(=O)O[C@H](CO/C=C/CCCCCCCCCCCCCC)COP(=O)(O)OCCN
MNX internals
InChI (mnx)InChI=1/C39H74NO7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-39(41)47-38(37-46-48(42,43)45-35-33-40)36-44-34-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h11,13,17,19,31,34,38H,3-10,12,14-16,18,20-30,32-33,35-37,40H2,1-2H3,(H,42,43)/b13-11+,19-17+,34-31+/t38-/m1/s1 Image of MNXM32918
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]/[CH2:15]/[CH:17]=[CH:19]/[CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:39](=[O:41])[O:47][C@H:38]([CH2:36][O:44]/[CH:34]=[CH:31]/[CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[CH2:37][O:46][P:48]([OH:42])(=[O:43])[O:45][CH2:35][CH2:33][NH2:40]
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:59478
chebi:59478
LJVXDBWIBQQKFU-YTHBNWPCSA-N
1-O-(hexadec-1-enyl)-2-O-octadeca-9,12-dienoyl-sn-glycero-3-phosphoethanolamine
(15E,19R)-25-amino-22-hydroxy-22-oxido-17,21,23-trioxa-22lambda(5)-phosphapentacos-15-en-19-yl (9E,12E)-octadeca-9,12-dienoate
1-O-(hexadec-1-enyl)-2-O-octadecadienoyl-sn-glycero-3-phosphoethanolamine