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1-(9Z,11E-octadecadienoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1047770 Image of MNXM1047770
referenceslm:000740159
formulaC33H61NO8P
global charge-1
mol weight630.824
InChIKeyPUGTYVTWJIPPAB-DPCGUKTISA-M
InChIInChI=1S/C33H62NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-33(37)40-29-31(35)30-42-43(38,39)41-28-27-34-32(36)25-23-21-19-10-8-6-4-2/h12-15,31,35H,3-11,16-30H2,1-2H3,(H,34,36)(H,38,39)/p-1/b13-12+,15-14-/t31-/m1/s1
SMILESCCCCCC/C=C/C=C\CCCCCCCC(=O)OC[C@@H](O)COP(=O)([O-])OCCNC(=O)CCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C33H62NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-22-24-26-33(37)40-29-31(35)30-42-43(38,39)41-28-27-34-32(36)25-23-21-19-10-8-6-4-2/h12-15,31,35H,3-11,16-30H2,1-2H3,(H,34,36)(H,38,39)/b13-12+,15-14-/t31-/m1/s1 Image of MNXM1047770
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:12]=[CH:13]/[CH:14]=[CH:15]\[CH2:16][CH2:17][CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][C:33](=[O:37])[O:40][CH2:29][C@H:31]([CH2:30][O:42][P:43]([OH:38])(=[O:39])[O:41][CH2:28][CH2:27][N:34]=[C:32]([CH2:25][CH2:23][CH2:21][CH2:19][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])[OH:36])[OH:35]
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

SLM:000740159
slm:000740159
PUGTYVTWJIPPAB-DPCGUKTISA-M
1-(9Z,11E-octadecadienoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine
N-decanoyl-1-(9Z,11E-octadecadienoyl)-sn-glycero-3-phosphoethanolamine
NAPE (18:2(9Z,11E)/0:0/10:0)