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1-docosanoyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphate

PropertiesImage
MNX_IDMNXM346491 Image of MNXM346491
referenceslm:000025748
formulaC40H77O8P
global charge-2
mol weight717.022
InChIKeyHZAMZWIVSBVJFK-KXQOOQHDSA-L
InChIInChI=1S/C40H79O8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-39(41)46-35-38(36-47-49(43,44)45)48-40(42)34-31-28-25-22-19-20-23-26-29-32-37(2)3/h37-38H,4-36H2,1-3H3,(H2,43,44,45)/p-2/t38-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C40H79O8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-27-30-33-39(41)46-35-38(36-47-49(43,44)45)48-40(42)34-31-28-25-22-19-20-23-26-29-32-37(2)3/h37-38H,4-36H2,1-3H3,(H2,43,44,45)/t38-/m1/s1 Image of MNXM346491
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][CH2:33][C:39](=[O:41])[O:46][CH2:35][C@H:38]([CH2:36][O:47][P:49]([OH:43])([OH:44])=[O:45])[O:48][C:40]([CH2:34][CH2:31][CH2:28][CH2:25][CH2:22][CH2:19][CH2:20][CH2:23][CH2:26][CH2:29][CH2:32][CH:37]([CH3:2])[CH3:3])=[O:42]
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:000025748
slm:000025748
HZAMZWIVSBVJFK-KXQOOQHDSA-L
1-docosanoyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphate
PA(22:0/15:0)
Phosphatidate (22:0/15:0)
hmdb:HMDB0115671
HZAMZWIVSBVJFK-KXQOOQHDSA-N
PA(22:0/i-15:0)
(2R)-3-(docosanoyloxy)-2-[(13-methyltetradecanoyl)oxy]propoxyphosphonic acid
1-behenoyl-2-isopentadecanoyl-sn-glycero-3-phosphate
1-behenoyl-2-isopentadecanoyl-sn-phosphatidic acid
PA(37:0)
Phosphatidate(22:0/i-15:0)
Phosphatidate(37:0)
Phosphatidic acid(22:0/i-15:0)
Phosphatidic acid(37:0)
[(2R)-3-(Docosanoyloxy)-2-[(13-methyltetradecanoyl)oxy]propoxy]phosphonate
[(2R)-3-(docosanoyloxy)-2-[(13-methyltetradecanoyl)oxy]propoxy]phosphonic acid