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1-butanoyl-2-hexanoyl-sn-glycero-3-phospho-1D-myo-inositol-3,4,5-trisphosphate

PropertiesImage
MNX_IDMNXM344362 Image of MNXM344362
referenceslm:000443782
formulaC19H31O22P4
global charge-7
mol weight735.331
InChIKeyIYOFXOTVUWHRQU-WIQBWWRKSA-G
InChIInChI=1S/C19H38O22P4/c1-3-5-6-8-13(21)37-11(9-35-12(20)7-4-2)10-36-45(33,34)41-16-14(22)17(38-42(24,25)26)19(40-44(30,31)32)18(15(16)23)39-43(27,28)29/h11,14-19,22-23H,3-10H2,1-2H3,(H,33,34)(H2,24,25,26)(H2,27,28,29)(H2,30,31,32)/p-7/t11-,14+,15+,16-,17+,18-,19-/m1/s1
SMILESCCCCCC(=O)O[C@H](COC(=O)CCC)COP(=O)([O-])O[C@H]1[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@@H](OP(=O)([O-])[O-])[C@H]1O
MNX internals
InChI (mnx)InChI=1/C19H38O22P4/c1-3-5-6-8-13(21)37-11(9-35-12(20)7-4-2)10-36-45(33,34)41-16-14(22)17(38-42(24,25)26)19(40-44(30,31)32)18(15(16)23)39-43(27,28)29/h11,14-19,22-23H,3-10H2,1-2H3,(H,33,34)(H2,24,25,26)(H2,27,28,29)(H2,30,31,32)/t11-,14+,15+,16-,17+,18-,19-/m1/s1 Image of MNXM344362
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:6][CH2:8][C:13](=[O:21])[O:37][C@H:11]([CH2:9][O:35][C:12]([CH2:7][CH2:4][CH3:2])=[O:20])[CH2:10][O:36][P:45]([OH:33])(=[O:34])[O:41][C@@H:16]1[C@H:14]([OH:22])[C@H:17]([O:38][P:42]([OH:24])([OH:25])=[O:26])[C@@H:19]([O:40][P:44]([OH:30])([OH:31])=[O:32])[C@H:18]([O:39][P:43]([OH:27])([OH:28])=[O:29])[C@H:15]1[OH:23]
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:000443782
slm:000443782
IYOFXOTVUWHRQU-WIQBWWRKSA-G
1-butanoyl-2-hexanoyl-sn-glycero-3-phospho-1D-myo-inositol-3,4,5-trisphosphate
PIP3[3,4,5](4:0/6:0)