Hydrocortisone 21-(sodium 3-sulfonatobenzoate)

CAS

33767-03-2

Catalog Number

ACM33767032

Category

Other Products

Molecular Weight

568.610990 [g/mol]

Molecular Formula

C₂₈H₃₄O₉SNa

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 251-671-3, CID118102, Hydrocortisone 21-(sodium 3-sulphonatobenzoate), Cortisol, 21-(m-sulfobenzoate), monosodium salt, 33767-03-2, Pregn-4-ene-3,20-dione, 11,17-dihydroxy-21-((3-sulfobenzoyl)oxy)-, monosodium salt, (11beta)-

IUPAC Name

sodium 3-[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethoxy]carbonylbenzenesulfonate

Canonical SMILES

CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4(C(=O)COC(=O)C5=CC(=CC=C5)S(=O)(=O)[O-])O)C)O.[Na+]

InChI Key

XGCAQYZQAVKKHC-VDYYWZOJSA-M

EC Number

251-671-3

H-Bond Acceptor

H-Bond Donor