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Merck
CN

38896

Sigma-Aldrich

5-Bromo-4-chloro-3-indolyl-myo-inositol 1-phosphate ammonium salt

≥95.0% (HPLC)

Synonym(s):

X-myo-inositol phosphate

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About This Item

Empirical Formula (Hill Notation):
C14H16BrClNO9P · NH3
CAS Number:
Molecular Weight:
505.64
UNSPSC Code:
12352204
PubChem Substance ID:
NACRES:
NA.83
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Assay

≥95.0% (HPLC)

form

powder

SMILES string

[NH4+].O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](OP([O-])(=O)Oc2c[nH]c3ccc(Br)c(Cl)c23)[C@H](O)[C@H]1O

InChI

1S/C14H16BrClNO9P.H3N/c15-4-1-2-5-7(8(4)16)6(3-17-5)25-27(23,24)26-14-12(21)10(19)9(18)11(20)13(14)22;/h1-3,9-14,17-22H,(H,23,24);1H3/t9?,10-,11+,12-,13-,14?;/m1./s1

InChI key

HIFQQHVVHCJEPZ-STHBLVJOSA-N

General description

Sold for research purposes only, Biosynth patents WO 98/38332, US 6068988 for the detection of microbial metabolites with a 3-indoxyl-myo-inositol-1-phosphate compound.

Storage Class Code

13 - Non Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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