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1-acetyl-2-(11-methyldodecanoyl)-sn-glycero-3-phospho-1D-myo-inositol-3,4-bisphosphate

PropertiesImage
MNX_IDMNXM342155 Image of MNXM342155
referenceslm:000430845
formulaC24H42O19P3
global charge-5
mol weight727.503
InChIKeyOTHXCUVXDBYBKJ-IVDYOQSBSA-I
InChIInChI=1S/C24H47O19P3/c1-15(2)11-9-7-5-4-6-8-10-12-18(26)40-17(13-38-16(3)25)14-39-46(36,37)43-22-19(27)20(28)23(41-44(30,31)32)24(21(22)29)42-45(33,34)35/h15,17,19-24,27-29H,4-14H2,1-3H3,(H,36,37)(H2,30,31,32)(H2,33,34,35)/p-5/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](O)[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O)OC(=O)CCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C24H47O19P3/c1-15(2)11-9-7-5-4-6-8-10-12-18(26)40-17(13-38-16(3)25)14-39-46(36,37)43-22-19(27)20(28)23(41-44(30,31)32)24(21(22)29)42-45(33,34)35/h15,17,19-24,27-29H,4-14H2,1-3H3,(H,36,37)(H2,30,31,32)(H2,33,34,35)/t17-,19-,20-,21+,22+,23+,24+/m1/s1 Image of MNXM342155
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:40][C@H:17]([CH2:13][O:38][C:16]([CH3:3])=[O:25])[CH2:14][O:39][P:46]([OH:36])(=[O:37])[O:43][C@H:22]1[C@H:19]([OH:27])[C@@H:20]([OH:28])[C@H:23]([O:41][P:44]([OH:30])([OH:31])=[O:32])[C@@H:24]([O:42][P:45]([OH:33])([OH:34])=[O:35])[C@H:21]1[OH:29]
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:000430845
slm:000430845
OTHXCUVXDBYBKJ-IVDYOQSBSA-I
1-acetyl-2-(11-methyldodecanoyl)-sn-glycero-3-phospho-1D-myo-inositol-3,4-bisphosphate
PIP2[3,4](2:0/13:0)