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Phosphatidylserine (ditetradec-7-enoyl, n-C14:1)

PropertiesImage
MNX_IDMNXM7664 Image of MNXM7664
referencebiggM:ps141
formulaC34H60NO10P
global charge-2
mol weight673.825
InChIKeyHKOAHGRIQZVGSE-UHFFFAOYSA-L
InChIInChI=1S/C34H62NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-32(36)42-29-31(30-44-46(40,41)43-28-27-35-34(38)39)45-33(37)26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,31,35H,3-12,17-30H2,1-2H3,(H,38,39)(H,40,41)/p-2
SMILESCCCCCCC=CCCCCCC(=O)OCC(COP(=O)([O-])OCCNC(=O)[O-])OC(=O)CCCCCC=CCCCCCC
MNX internals
InChI (mnx)InChI=1/C34H62NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-32(36)42-29-31(30-44-46(40,41)43-28-27-35-34(38)39)45-33(37)26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,31,35H,3-12,17-30H2,1-2H3,(H,38,39)(H,40,41)/b15-13?,16-14?/t31? Image of MNXM7664
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH:13]=[CH:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][C:32](=[O:36])[O:42][CH2:29][CH:31]([CH2:30][O:44][P:46]([OH:40])(=[O:41])[O:43][CH2:28][CH2:27][NH:35][C:34](=[O:38])[OH:39])[O:45][C:33]([CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH:16]=[CH:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 4
Similar chemical compounds in external resources
IdentifierDescription

bigg.metabolite:ps141
biggM:ps141
HKOAHGRIQZVGSE-UHFFFAOYSA-L
Phosphatidylserine (ditetradec-7-enoyl, n-C14:1)

biggM:M_ps141
secondary/obsolete/fantasy identifier