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1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)(7-)

PropertiesImage
MNX_IDMNXM76877 Image of MNXM76877
referencechebi:83420
formulaC41H75O22P4
global charge-7
mol weight1043.925
InChIKeyZSZXYWFCIKKZBT-IVYVYLGESA-G
InChIInChI=1S/C41H82O22P4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)57-31-33(59-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-58-67(55,56)63-38-36(44)39(60-64(46,47)48)41(62-66(52,53)54)40(37(38)45)61-65(49,50)51/h33,36-41,44-45H,3-32H2,1-2H3,(H,55,56)(H2,46,47,48)(H2,49,50,51)(H2,52,53,54)/p-7/t33-,36+,37+,38-,39+,40-,41-/m1/s1
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@H](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)OC(=O)CCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C41H82O22P4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-34(42)57-31-33(59-35(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2)32-58-67(55,56)63-38-36(44)39(60-64(46,47)48)41(62-66(52,53)54)40(37(38)45)61-65(49,50)51/h33,36-41,44-45H,3-32H2,1-2H3,(H,55,56)(H2,46,47,48)(H2,49,50,51)(H2,52,53,54)/t33-,36+,37+,38-,39+,40-,41-/m1/s1 Image of MNXM76877
SMILES (mnx)[CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][C:34](=[O:42])[O:57][CH2:31][C@H:33]([CH2:32][O:58][P:67](=[O:55])([OH:56])[O:63][C@@H:38]1[C@H:36]([OH:44])[C@H:39]([O:60][P:64]([OH:46])(=[O:47])[OH:48])[C@@H:41]([O:62][P:66]([OH:52])(=[O:53])[OH:54])[C@H:40]([O:61][P:65](=[O:49])([OH:50])[OH:51])[C@H:37]1[OH:45])[O:59][C:35]([CH2:30][CH2:28][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:43]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:83420
chebi:83420
ZSZXYWFCIKKZBT-IVYVYLGESA-G 		1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)(7-)
(2R)-2,3-bis(hexadecanoyloxy)propyl (1S,2S,3R,5S,6S)-2,6-dihydroxy-3,4,5-tris(phosphonatooxy)cyclohexyl phosphate
1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)
1,2-dipalmitoyl-sn-glycero-3-phospho-(1D-myo-inositol 3,4,5-trisphosphate)(7-)
PIP3[3',4',5'](16:0/16:0)(7-)
PtdIns(3,4,5)P3diC16 (7-)

vmhM:g3pi345tp_12hdca
vmhM:g3pi345tp_12hdca
vmhmetabolite:g3pi345tp_12hdca
vmhmetabolite:g3pi345tp_12hdca
ZSZXYWFCIKKZBT-IVYVYLGESA-G 		1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-triphosphate)

CHEBI:84244
chebi:84244
ZSZXYWFCIKKZBT-IVYVYLGESA-N 		1,2-dihexadecanoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)
(2R)-3-{[{[(1S,2S,3R,4S,5S,6S)-2,6-dihydroxy-3,4,5-tris(phosphonooxy)cyclohexyl]oxy}(hydroxy)phosphoryl]oxy}propane-1,2-diyl dihexadecanoate
1,2-dipalmitoyl-sn-glycero-3-phospho-(1D-myo-inositol-3,4,5-trisphosphate)
PIP3(16:0/16:0)
PIP3(32:0)
PIP3[3',4',5'](16:0/16:0)
Phosphatidylinositol Triphosphate(16:0/16:0)
Phosphatidylinositol Triphosphate(32:0)

SLM:000443623
slm:000443623
ZSZXYWFCIKKZBT-IVYVYLGESA-G 		1,2-dihexadecanoyl-sn-glycero-3-phospho-1D-myo-inositol-3,4,5-trisphosphate
PIP3[3,4,5](16:0/16:0)

vmhM:M_g3pi345tp_12hdca 		secondary/obsolete/fantasy identifier