Search MNXref
 Feedback

saturated 1-archaetidyl-1D-myo-inositol 3-phosphate

MNXM146309 is deprecated and here replaced by MNXM728778
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM728778 Image of MNXM728778
referencechebi:74006
formulaC49H97O14P2
global charge-3
mol weight972.249
InChIKeyZEUIOZPPYUDCRR-YLALLHFRSA-K
InChIInChI=1S/C49H100O14P2/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-59-33-43(60-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4)34-61-65(57,58)63-49-46(52)44(50)45(51)48(47(49)53)62-64(54,55)56/h35-53H,11-34H2,1-10H3,(H,57,58)(H2,54,55,56)/p-3/t37-,38-,39-,40-,41-,42-,43+,44+,45+,46-,47-,48-,49+/m1/s1
SMILESCC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@H](C)CCOC[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)OCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C
MNX internals
InChI (mnx)InChI=1/C49H100O14P2/c1-35(2)17-11-19-37(5)21-13-23-39(7)25-15-27-41(9)29-31-59-33-43(60-32-30-42(10)28-16-26-40(8)24-14-22-38(6)20-12-18-36(3)4)34-61-65(57,58)63-49-46(52)44(50)45(51)48(47(49)53)62-64(54,55)56/h35-53H,11-34H2,1-10H3,(H,57,58)(H2,54,55,56)/t37-,38-,39-,40-,41-,42-,43+,44+,45+,46-,47-,48-,49+/m1/s1 Image of MNXM728778
SMILES (mnx)[CH3:1][CH:35]([CH3:2])[CH2:17][CH2:11][CH2:19][C@@H:37]([CH3:5])[CH2:21][CH2:13][CH2:23][C@@H:39]([CH3:7])[CH2:25][CH2:15][CH2:27][C@@H:41]([CH3:9])[CH2:29][CH2:31][O:59][CH2:33][C@@H:43]([CH2:34][O:61][P:65]([OH:57])(=[O:58])[O:63][C@H:49]1[C@H:46]([OH:52])[C@@H:44]([OH:50])[C@H:45]([OH:51])[C@@H:48]([O:62][P:64]([OH:54])([OH:55])=[O:56])[C@H:47]1[OH:53])[O:60][CH2:32][CH2:30][C@H:42]([CH3:10])[CH2:28][CH2:16][CH2:26][C@H:40]([CH3:8])[CH2:24][CH2:14][CH2:22][C@H:38]([CH3:6])[CH2:20][CH2:12][CH2:18][CH:36]([CH3:3])[CH3:4]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 1
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:74006
chebi:74006
ZEUIOZPPYUDCRR-YLALLHFRSA-K 		saturated 1-archaetidyl-1D-myo-inositol 3-phosphate
(2S)-2,3-bis{[(3R,7R,11R)-3,7,11,15-tetramethylhexadecyl]oxy}propyl (1S,2R,3S,4S,5R,6R)-2,3,4,6-tetrahydroxy-5-(phosphonatooxy)cyclohexyl phosphate
1-archaetidyl-1D-myo-inositol 3-phosphate(3-)
AIP
archaetidylinositol phosphate(3-)
saturated archaetidylinositol 3-phosphate

seed.compound:cpd31251
seedM:cpd31251
kegg.compound:C20642
keggC:C20642
ZEUIOZPPYUDCRR-RSLURMCMSA-K
ZEUIOZPPYUDCRR-RSLURMCMSA-N 		1-Archaetidyl-1D-myo-inositol 3-phosphate
1-Saturated archaetidyl-1D-myo-inositol 3-phosphate
Archaetidylinositol phosphate

CHEBI:74081
chebi:74081
ZEUIOZPPYUDCRR-YLALLHFRSA-N 		1-archaetidyl-1D-myo-inositol 3-phosphate
(1R,2R,3S,4R,5S,6S)-3-({[(2S)-2,3-bis{[(3R,7R,11R)-3,7,11,15-tetramethylhexadecyl]oxy}propoxy](hydroxy)phosphoryl}oxy)-2,4,5,6-tetrahydroxycyclohexyl dihydrogen phosphate
1-saturated archaetidyl-1D-myo-inositol 3-phosphate
2,3-diphytanyl-sn-glycero-1-phospho-(1'-myo-inositol-3'-phosphate)
AIP
archaetidylinositol phosphate
saturated archaetidylinositol 3-phosphate

seed.compound:cpd34057
seedM:cpd34057
ZEUIOZPPYUDCRR-YLALLHFRSA-K 		1-saturated archaetidyl-1D-myo-inositol 3-phosphate
saturated archaetidylinositol 1-phosphate
saturated archaetidylinositol phosphate

metacyc.compound:CPD-15255
metacycM:CPD-15255
ZEUIOZPPYUDCRR-YLALLHFRSA-K 		2,3-bis-O-phytanyl-sn-glycero-1-phospho-1'-myo-inositol 3-phosphate
1-saturated archaetidyl-1D-myo-inositol 3-phosphate
saturated archaetidylinositol 1-phosphate
saturated archaetidylinositol phosphate

keggC:M_C20642
seedM:M_cpd31251
seedM:M_cpd34057 		secondary/obsolete/fantasy identifier