CHEBI:166489 - Inositol 1,3,4,5-tetraphosphate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Inositol 1,3,4,5-tetraphosphate
ChEBI ID CHEBI:166489
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C6H16O18P4
Net Charge 0
Average Mass 500.071
Monoisotopic Mass 499.92871
InChI InChI=1S/C6H16O18P4/c7-1-3(21-25(9,10)11)2(8)5(23-27(15,16)17)6(24-28(18,19)20)4(1)22-26(12,13)14/h1-8H,(H2,9,10,11)(H2,12,13,14)(H2,15,16,17)(H2,18,19,20)/t1-,2-,3?,4-,5+,6?/m0/s1
InChIKey CIPFCGZLFXVXBG-FTSGZOCFSA-N
SMILES P(OC1[C@@H](OP(O)(O)=O)[C@@H](O)C(OP(O)(O)=O)[C@H](O)[C@H]1OP(O)(O)=O)(O)(O)=O
ChEBI Ontology
Outgoing Inositol 1,3,4,5-tetraphosphate (CHEBI:166489) is a inositol phosphate (CHEBI:24846)
IUPAC Name
[(1S,2S,4S,5R)-2,4-dihydroxy-3,5,6-triphosphonooxycyclohexyl] dihydrogen phosphate
Manual Xrefs Databases
96919 ChemSpider
C01272 KEGG COMPOUND
CPD-506 MetaCyc
HMDB0001059 HMDB
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