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1-(9Z,12Z-hexadecadienoyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM324391 Image of MNXM324391
referenceslm:000012084
formulaC38H70NO8P
global charge0
mol weight699.951
InChIKeyMKOPTVPYKYSQFT-SDFDOATCSA-N
InChIInChI=1S/C38H70NO8P/c1-6-8-10-12-14-16-18-19-21-22-24-26-28-30-37(40)44-34-36(35-46-48(42,43)45-33-32-39(3,4)5)47-38(41)31-29-27-25-23-20-17-15-13-11-9-7-2/h10,12-13,15-16,18,36H,6-9,11,14,17,19-35H2,1-5H3/b12-10-,15-13-,18-16-/t36-/m1/s1
SMILESCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCC
MNX internals
InChI (mnx)InChI=1/C38H70NO8P/c1-6-8-10-12-14-16-18-19-21-22-24-26-28-30-37(40)44-34-36(35-46-48(42,43)45-33-32-39(3,4)5)47-38(41)31-29-27-25-23-20-17-15-13-11-9-7-2/h10,12-13,15-16,18,36H,6-9,11,14,17,19-35H2,1-5H3/b12-10-,15-13-,18-16-/t36-/m1/s1 Image of MNXM324391
SMILES (mnx)[CH3:1][CH2:6][CH2:8]/[CH:10]=[CH:12]\[CH2:14]/[CH:16]=[CH:18]\[CH2:19][CH2:21][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][C:37](=[O:40])[O:44][CH2:34][C@H:36]([CH2:35][O:46][P:48](=[O:42])([O-:43])[O:45][CH2:33][CH2:32][N+:39]([CH3:3])([CH3:4])[CH3:5])[O:47][C:38]([CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:20][CH2:17]/[CH:15]=[CH:13]\[CH2:11][CH2:9][CH2:7][CH3:2])=[O:41]
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:000012084
slm:000012084
MKOPTVPYKYSQFT-SDFDOATCSA-N
1-(9Z,12Z-hexadecadienoyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine
PC(16:2(9Z,12Z)/14:1(9Z))
Phosphatidylcholine (16:2(9Z,12Z)/14:1(9Z))