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1-acetyl-2-(11-methyldodecanoyl)-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate

PropertiesImage
MNX_IDMNXM342157 Image of MNXM342157
referenceslm:000456437
formulaC24H43O16P2
global charge-3
mol weight649.54
InChIKeyNQNZXJFHPPJHIV-PKPYTNAASA-K
InChIInChI=1S/C24H46O16P2/c1-15(2)11-9-7-5-4-6-8-10-12-18(26)38-17(13-36-16(3)25)14-37-42(34,35)40-24-21(29)19(27)20(28)23(22(24)30)39-41(31,32)33/h15,17,19-24,27-30H,4-14H2,1-3H3,(H,34,35)(H2,31,32,33)/p-3/t17-,19+,20+,21-,22-,23-,24+/m1/s1
SMILESCC(=O)OC[C@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](OP(=O)([O-])[O-])[C@@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C24H46O16P2/c1-15(2)11-9-7-5-4-6-8-10-12-18(26)38-17(13-36-16(3)25)14-37-42(34,35)40-24-21(29)19(27)20(28)23(22(24)30)39-41(31,32)33/h15,17,19-24,27-30H,4-14H2,1-3H3,(H,34,35)(H2,31,32,33)/t17-,19+,20+,21-,22-,23-,24+/m1/s1 Image of MNXM342157
SMILES (mnx)[CH3:1][CH:15]([CH3:2])[CH2:11][CH2:9][CH2:7][CH2:5][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][C:18](=[O:26])[O:38][C@H:17]([CH2:13][O:36][C:16]([CH3:3])=[O:25])[CH2:14][O:37][P:42]([OH:34])(=[O:35])[O:40][C@H:24]1[C@H:21]([OH:29])[C@@H:19]([OH:27])[C@H:20]([OH:28])[C@@H:23]([O:39][P:41]([OH:31])([OH:32])=[O:33])[C@H:22]1[OH:30]
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:000456437
slm:000456437
NQNZXJFHPPJHIV-PKPYTNAASA-K
1-acetyl-2-(11-methyldodecanoyl)-sn-glycero-3-phospho-1D-myo-inositol-3-phosphate
PIP[3](2:0/13:0)