CAS 1246355-66-7 D-myo-inositol-1,3,4-trisphosphate (ammonium salt)

What is the chemical structure of D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

The chemical structure of D-myo-inositol-1,3,4-trisphosphate (ammonium salt) is C1(C(C(C(C(C1OP(=O)(O)[O-])O)OP(=O)(O)[O-])OP(=O)(O)[O-])O)O).[NH4+].[NH4+].[NH4+]

What is the molecular formula of D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

The molecular formula is C6H24N3O15P3.

What is the molecular weight of D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

The molecular weight is 471.19g/mol.

How many heavy atoms are present in D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

There are 27 heavy atoms.

How many hydrogen bond acceptors are there in D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

There are 15 hydrogen bond acceptors.

What is the canonical SMILES representation of D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

The canonical SMILES is C1(C(C(C(C(C1OP(=O)(O)[O-])O)OP(=O)(O)[O-])OP(=O)(O)[O-])O)O).[NH4+].[NH4+].[NH4+].

How many computed properties defined atom stereocenters are there in D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

There are 2 computed properties defined atom stereocenters.

What is the InChI key for D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

The InChI key is VWIVRRVMXAKDSS-GAMKYWJDSA-N.

What are some common synonyms for D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

Some common synonyms include IP3(1,3,4) and powder.

How many rotatable bonds are present in D-myo-inositol-1,3,4-trisphosphate (ammonium salt)?

There are 6 rotatable bonds.

Catalog Number	ACM1246355667
CAS	1246355-66-7
Synonyms	IP3(1,3,4)
IUPAC Name	Azane;[(1S,2R,3R,4S,5S,6S)-2,3,5-trihydroxy-4,6-diphosphonooxycyclohexyl] dihydrogen phosphate
Molecular Weight	471.19
Molecular Formula	C6H24N3O15P3
Canonical SMILES	O[C@H]1[C@@H]([C@H](O)[C@H](OP(O)([O-])=O)[C@@H](OP([O-])(O)=O)[C@@H]1O)OP(O)([O-])=O.[NH4+].[NH4+].[NH4+]
Purity	97%+
Physical State	Powder
Storage Conditions	-20 °C