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1-(11E-octadecenoyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine

PropertiesImage
MNX_IDMNXM192070 Image of MNXM192070
referenceslm:000008055
formulaC40H76NO8P
global charge0
mol weight730.021
InChIKeyKVLXYLCYQNSPQA-ZFQFWKBPSA-N
InChIInChI=1S/C40H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-23-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-22-17-15-13-11-9-7-2/h13,15-16,18,38H,6-12,14,17,19-37H2,1-5H3/b15-13-,18-16+/t38-/m1/s1
SMILESCCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C/CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
MNX internals
InChI (mnx)InChI=1/C40H76NO8P/c1-6-8-10-12-14-16-18-19-20-21-23-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-22-17-15-13-11-9-7-2/h13,15-16,18,38H,6-12,14,17,19-37H2,1-5H3/b15-13-,18-16+/t38-/m1/s1 Image of MNXM192070
SMILES (mnx)[CH3:1][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14]/[CH:16]=[CH:18]/[CH2:19][CH2:20][CH2:21][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:39](=[O:42])[O:46][CH2:36][C@H:38]([CH2:37][O:48][P:50](=[O:44])([O-:45])[O:47][CH2:35][CH2:34][N+:41]([CH3:3])([CH3:4])[CH3:5])[O:49][C:40]([CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:22][CH2:17]/[CH:15]=[CH:13]\[CH2:11][CH2:9][CH2:7][CH3:2])=[O:43]
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:000008055
slm:000008055
KVLXYLCYQNSPQA-ZFQFWKBPSA-N
1-(11E-octadecenoyl)-2-(9Z-tetradecenoyl)-sn-glycero-3-phosphocholine
PC(18:1(11E)/14:1(9Z))
Phosphatidylcholine (18:1(11E)/14:1(9Z))