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PA(18:1(9Z)/18:3(9Z,12Z,15Z))

PropertiesImage
MNX_IDMNXM32558 Image of MNXM32558
referencechebi:170168
formulaC39H69O8P
global charge0
mol weight696.947
InChIKeyISQZDMYWHAMARJ-GXCBCVOFSA-N
InChIInChI=1S/C39H69O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,17-20,37H,3-5,7,9-11,13,15-16,21-36H2,1-2H3,(H2,42,43,44)/b8-6-,14-12-,19-17-,20-18-/t37-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCCCC)COP(=O)(O)O
MNX internals
InChI (mnx)InChI=1/C39H69O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,17-20,37H,3-5,7,9-11,13,15-16,21-36H2,1-2H3,(H2,42,43,44)/b8-6-,14-12-,19-17-,20-18-/t37-/m1/s1 Image of MNXM32558
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][CH2:33][C:38](=[O:40])[O:45][CH2:35][C@H:37]([CH2:36][O:46][P:48]([OH:42])([OH:43])=[O:44])[O:47][C:39]([CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:41]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:170168
chebi:170168
ISQZDMYWHAMARJ-GXCBCVOFSA-N 		PA(18:1(9Z)/18:3(9Z,12Z,15Z))
[(2R)-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-3-phosphonooxypropyl] (Z)-octadec-9-enoate

seed.compound:cpd25129
seedM:cpd25129
ISQZDMYWHAMARJ-GXCBCVOFSA-L 		1-(9Z-octadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphate
1-18:1-2-18:3-phosphatidate
1-18:1-2-18:3-phosphatidic acid
18:1-18:3-PA

SLM:000025326
slm:000025326
ISQZDMYWHAMARJ-GXCBCVOFSA-L 		1-(9Z-octadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphate
PA(18:1(9Z)/18:3(9Z,12Z,15Z))
Phosphatidate (18:1(9Z)/18:3(9Z,12Z,15Z))

metacyc.compound:CPD-8272
metacycM:CPD-8272
ISQZDMYWHAMARJ-GXCBCVOFSA-L 		1-18:1-2-18:3-phosphatidate
1-(9Z-octadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphate
1-18:1-2-18:3-phosphatidic acid
18:1-18:3-PA
hmdb:HMDB0114929
ISQZDMYWHAMARJ-GXCBCVOFSA-N 		PA(18:1(9Z)/18:3(9Z,12Z,15Z))
(2R)-3-[(9Z)-octadec-9-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxyphosphonic acid
1-oleoyl-2-alpha-linolenoyl-sn-glycero-3-phosphate
1-oleoyl-2-alpha-linolenoyl-sn-phosphatidic acid
PA(18:1/18:3)
PA(18:1n9/18:3n3)
PA(18:1w9/18:3w3)
PA(36:4)
Phosphatidate(18:1(9Z)/18:3(9Z,12Z,15Z))
Phosphatidate(18:1/18:3)
Phosphatidate(18:1n9/18:3n3)
Phosphatidate(18:1w9/18:3w3)
Phosphatidate(36:4)
Phosphatidic acid(18:1(9Z)/18:3(9Z,12Z,15Z))
Phosphatidic acid(18:1/18:3)
Phosphatidic acid(18:1n9/18:3n3)
Phosphatidic acid(18:1w9/18:3w3)
Phosphatidic acid(36:4)
[(2R)-3-[(9Z)-octadec-9-enoyloxy]-2-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyloxy]propoxy]phosphonic acid

lipidmaps:LMGP10010880
lipidmapsM:LMGP10010880
ISQZDMYWHAMARJ-GXCBCVOFSA-N 		PA(18:1(9Z)/18:3(9Z,12Z,15Z))
1-(9Z-octadecenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-glycero-3-phosphate
PA 36:4
PA(18:1_18:3)
PA(36:4)

seedM:M_cpd25129 		secondary/obsolete/fantasy identifier