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PGP(16:1(9Z)/16:1(9Z))

MNXM75103 is deprecated and here replaced by MNXM1108461
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1108461 Image of MNXM1108461
referencechebi:169479
formulaC38H72O13P2
global charge0
mol weight798.929
InChIKeyPTJJTQQVMKSSOK-NWHZUZAFSA-N
InChIInChI=1S/C38H72O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(40)47-33-36(34-50-53(45,46)49-32-35(39)31-48-52(42,43)44)51-38(41)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,35-36,39H,3-12,17-34H2,1-2H3,(H,45,46)(H2,42,43,44)/b15-13-,16-14-/t35-,36+/m0/s1
SMILESCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)(O)OC[C@@H](O)COP(=O)(O)O)OC(=O)CCCCCCC/C=C\CCCCCC
MNX internals
InChI (mnx)InChI=1/C38H72O13P2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(40)47-33-36(34-50-53(45,46)49-32-35(39)31-48-52(42,43)44)51-38(41)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,35-36,39H,3-12,17-34H2,1-2H3,(H,45,46)(H2,42,43,44)/b15-13-,16-14-/t35-,36+/m0/s1 Image of MNXM1108461
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][CH2:27][CH2:29][C:37](=[O:40])[O:47][CH2:33][C@H:36]([CH2:34][O:50][P:53]([OH:45])(=[O:46])[O:49][CH2:32][C@H:35]([CH2:31][O:48][P:52]([OH:42])([OH:43])=[O:44])[OH:39])[O:51][C:38]([CH2:30][CH2:28][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:41]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:169479
chebi:169479
PTJJTQQVMKSSOK-NWHZUZAFSA-N 		PGP(16:1(9Z)/16:1(9Z))
[(2R)-2-[(Z)-hexadec-9-enoyl]oxy-3-[hydroxy-[(2S)-2-hydroxy-3-phosphonooxypropoxy]phosphoryl]oxypropyl] (Z)-hexadec-9-enoate

SLM:000475605
slm:000475605
PTJJTQQVMKSSOK-NWHZUZAFSA-K 		1,2-di-(9Z-hexadecenoyl)-sn-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
PGP(16:1(9Z)/16:1(9Z))
Phosphatidylglycerophosphate (16:1(9Z)/16:1(9Z))
hmdb:HMDB0013488
PTJJTQQVMKSSOK-NWHZUZAFSA-N 		PGP(16:1(9Z)/16:1(9Z))
(2S)-3-{[(2R)-2,3-bis[(9Z)-hexadec-9-enoyloxy]propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxyphosphonic acid
1,2-di(9Z-hexadecenoyl)-rac-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
1,2-dipalmitoleoyl-rac-glycero-3-phospho-(1'-sn-glycerol-3'-phosphate)
3-sn-phosphatidyl-1'-sn-glycerol 3'-phosphoric acid
PGP(16:1/16:1)
PGP(16:1W7/16:1W7)
PGP(16:1n7/16:1n7)
PGP(32:2)
[(2S)-3-({[(2R)-2,3-bis[(9Z)-hexadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy]phosphonic acid

seed.compound:cpd26451
seedM:cpd26451
PTJJTQQVMKSSOK-NWHZUZAFSA-K 		Phosphatidylglycerophosphate (dihexadec-9-enoyl, n-C16:1)
phosphatidylglycerophosphate (dihexadec-9-enoyl, n-C16:1)

metacyc.compound:CPD0-2230
metacycM:CPD0-2230
PTJJTQQVMKSSOK-NWHZUZAFSA-K 		phosphatidylglycerolphosphate (1,2-di-palmitoleoyl)
phosphatidylglycerolphosphate (dihexadec-9-enoyl, n-C16:1)

hmdb:HMDB13488
seedM:M_cpd26451 		secondary/obsolete/fantasy identifier