CHEBI:62927 - 3-diphospho-1D-myo-inositol 1,4,5,6-tetrakisphosphate

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ChEBI Name 3-diphospho-1D-myo-inositol 1,4,5,6-tetrakisphosphate ChEBI ID CHEBI:62927 ChEBI ASCII Name 3-diphospho-1D-myo-inositol 1,4,5,6-tetrakisphosphate Definition A myo-inositol tetrakisphosphate that consists of myo-inositol having the four phospho groups located at positions 1, 4, 5 and 6 as well as a diphospho group at position 3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Mark Williams Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H18O24P6 Net Charge 0 Average Mass 660.03530 Monoisotopic Mass 659.86137 InChI InChI=1S/C6H18O24P6/c7-1-2(25-31(8,9)10)4(26-32(11,12)13)6(28-34(17,18)19)5(27-33(14,15)16)3(1)29-36(23,24)30-35(20,21)22/h1-7H,(H,23,24)(H2,8,9,10)(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)(H2,20,21,22)/t1-,2+,3-,4-,5+,6+/m0/s1 InChIKey RLQGQDJUKRAXDX-UZAAGFTCSA-N SMILES O[C@H]1[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@@H](OP(O)(O)=O)[C@H](OP(O)(O)=O)[C@H]1OP(O)(=O)OP(O)(O)=O ChEBI Ontology Outgoing 3-diphospho-1D-myo-inositol 1,4,5,6-tetrakisphosphate (CHEBI:62927) has functional parent myo-inositol (CHEBI:17268) 3-diphospho-1D-myo-inositol 1,4,5,6-tetrakisphosphate (CHEBI:62927) is a myo-inositol tetrakisphosphate (CHEBI:25449) IUPAC Name 1,4,5,6-tetrakis-O-phosphono-1D-myo-inositol 3-(trihydrogen diphosphate) Synonyms Sources (1S,2S,3R,4S,5R,6R)-2-hydroxy-3,4,5,6-tetrakis(phosphonooxy)cyclohexyl trihydrogen diphosphate IUPAC 3-PP-IP4 SUBMITTER Last Modified 18 October 2011