1,3,5[10]-Estratriene-3,17beta-diol 3-glucuronide 17-sulfate dipotassium salt

Catalog Number

ACM99156453

Product Name

1,3,5[10]-Estratriene-3,17beta-diol 3-glucuronide 17-sulfate dipotassium salt

Structure

CAS

99156-45-3

Category

Heterocyclic Organic Compound

Synonyms

beta-Estradiol 3-(beta-D-glucuronide) 17-sulfate dipotassium salt, 99156-45-3, E2128_SIGMA, CTK8G3971, AG-L-65125, |A-Estradiol 3-(|A-D-glucuronide) 17-sulfate dipotassium salt, 1,3,5(10)-Estratriene-3,17|A-diol 3-glucuronide 17-sulfate, 1,3,5(10)-Estratriene-3,17beta-diol 3-glucuronide 17-sulfate, 3,17|A-Dihydroxy-1,3,5(10)-estratriene 3-glucuronide 17-sulfate, 3,17beta-Dihydroxy-1,3,5(10)-estratriene 3-glucuronide 17-sulfate

IUPAC Name

potassium;3,4,5-trihydroxy-6-[(13-methyl-17-sulfooxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl)oxy]oxane-2-carboxylic acid

Molecular Weight

604.75

Molecular Formula

C₂₄H₃₀K₂O₁₁S

Canonical SMILES

CC12CCC3C(C1CCC2OS(=O)(=O)O)CCC4=C3C=CC(=C4)OC5C(C(C(C(O5)C(=O)O)O)O)O.[K]

InChI Key

VNSWOHHNKXNEBZ-UHFFFAOYSA-N

Exact Mass

604.07800

Hazard Statements

Xn

H-Bond Acceptor

11

H-Bond Donor

5

MSDS

COA

Spec Sheet