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PE(13:0/18:1(9Z))

PropertiesImage
MNX_IDMNXM71220 Image of MNXM71220
referencechebi:178297
formulaC36H70NO8P
global charge0
mol weight675.929
InChIKeyOKGJZBWVHVRTLI-ALNMSFLZSA-N
InChIInChI=1S/C36H70NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-36(39)45-34(33-44-46(40,41)43-31-30-37)32-42-35(38)28-26-24-22-20-14-12-10-8-6-4-2/h16-17,34H,3-15,18-33,37H2,1-2H3,(H,40,41)/b17-16-/t34-/m1/s1
SMILESCCCCCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC)COP(=O)(O)OCCN
MNX internals
InChI (mnx)InChI=1/C36H70NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-36(39)45-34(33-44-46(40,41)43-31-30-37)32-42-35(38)28-26-24-22-20-14-12-10-8-6-4-2/h16-17,34H,3-15,18-33,37H2,1-2H3,(H,40,41)/b17-16-/t34-/m1/s1 Image of MNXM71220
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][C:36](=[O:39])[O:45][C@H:34]([CH2:32][O:42][C:35]([CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:38])[CH2:33][O:44][P:46]([OH:40])(=[O:41])[O:43][CH2:31][CH2:30][NH2:37]
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:178297
chebi:178297
OKGJZBWVHVRTLI-ALNMSFLZSA-N 		PE(13:0/18:1(9Z))
[(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-tridecanoyloxypropan-2-yl] (Z)-octadec-9-enoate

SLM:000036554
slm:000036554
OKGJZBWVHVRTLI-ALNMSFLZSA-N 		1-tridecanoyl-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
PE(13:0/18:1(9Z))
Phosphatidylethanolamine (13:0/18:1(9Z))

lipidmaps:LMGP02010390
lipidmapsM:LMGP02010390
OKGJZBWVHVRTLI-ALNMSFLZSA-N 		PE(13:0/18:1(9Z))
1-tridecanoyl-2-(9Z-octadecenoyl)-glycero-3-phosphoethanolamine
PE 31:1
PE(13:0_18:1)
PE(31:1)