CHEBI:62918 - 1D-myo-inositol 3,4,6-trisphosphate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1D-myo-inositol 3,4,6-trisphosphate
ChEBI ID CHEBI:62918
ChEBI ASCII Name 1D-myo-inositol 3,4,6-trisphosphate
Definition A myo-inositol trisphosphate having the three phosphate groups at the 3-, 4-, and 6-positions.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C6H15O15P3
Net Charge 0
Average Mass 420.09560
Monoisotopic Mass 419.96238
InChI InChI=1S/C6H15O15P3/c7-1-2(8)5(20-23(13,14)15)6(21-24(16,17)18)3(9)4(1)19-22(10,11)12/h1-9H,(H2,10,11,12)(H2,13,14,15)(H2,16,17,18)/t1-,2+,3-,4+,5+,6+/m1/s1
InChIKey MMWCIQZXVOZEGG-GSRZWBRNSA-N
SMILES O[C@@H]1[C@H](O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](O)[C@H]1OP(O)(O)=O
ChEBI Ontology
Outgoing 1D-myo-inositol 3,4,6-trisphosphate (CHEBI:62918) has functional parent myo-inositol (CHEBI:17268)
1D-myo-inositol 3,4,6-trisphosphate (CHEBI:62918) is a myo-inositol trisphosphate (CHEBI:25450)
IUPAC Name
1D-myo-inositol 3,4,6-tris(dihydrogen phosphate)
Synonyms Sources
(1S,2S,3R,4S,5R,6S)-3,5,6-trihydroxycyclohexane-1,2,4-triyl tris[dihydrogen (phosphate)] IUPAC
1D-myo-inositol (3,4,6)-trisphosphate MetaCyc
1D-myo-inositol 3,4,6-triphosphate ChEBI
1L-myo-inositol 1,4,6-trisphosphate ChEBI
D-Ins(3,4,6)P3 ChEBI
D-myo-inositol 3,4,6-triphosphate ChEBI
D-myo-inositol 3,4,6-trisphosphate ChEBI
I(3,4,6)P3 MetaCyc
L-myo-inositol 1,4,6-triphosphate ChEBI
L-myo-inositol 1,4,6-trisphosphate ChEBI
Manual Xref Database
CPD-6681 MetaCyc
View more database links
Registry Number Type Source
7629575 Reaxys Registry Number Reaxys
Last Modified
22 September 2011