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1-(10Z,13Z,16Z,19Z,22Z-octacosapentaenoyl)-2-hexanoyl-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM181729 Image of MNXM181729
referenceslm:000020924
formulaC37H61O8P
global charge-2
mol weight664.861
InChIKeyZJKHUPRXUATMFM-XLDOFICKSA-L
InChIInChI=1S/C37H63O8P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-29-6-4-2/h9-10,12-13,15-16,18-19,21-22,35H,3-8,11,14,17,20,23-34H2,1-2H3,(H2,40,41,42)/p-2/b10-9-,13-12-,16-15-,19-18-,22-21-/t35-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCC
MNX internals
InChI (mnx)InChI=1/C37H63O8P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-30-31-36(38)43-33-35(34-44-46(40,41)42)45-37(39)32-29-6-4-2/h9-10,12-13,15-16,18-19,21-22,35H,3-8,11,14,17,20,23-34H2,1-2H3,(H2,40,41,42)/b10-9-,13-12-,16-15-,19-18-,22-21-/t35-/m1/s1 Image of MNXM181729
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:31][C:36](=[O:38])[O:43][CH2:33][C@H:35]([CH2:34][O:44][P:46]([OH:40])([OH:41])=[O:42])[O:45][C:37]([CH2:32][CH2:29][CH2:6][CH2:4][CH3:2])=[O:39]
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:000020924
slm:000020924
ZJKHUPRXUATMFM-XLDOFICKSA-L
1-(10Z,13Z,16Z,19Z,22Z-octacosapentaenoyl)-2-hexanoyl-sn-glycero-3-phosphate
PA(28:5(10Z,13Z,16Z,19Z,22Z)/6:0)
Phosphatidate (28:5(10Z,13Z,16Z,19Z,22Z)/6:0)