Thieno[3,2-c]pyridine 4-Methylbenzenesulfonate

Analyte Name

Thieno[3,2-c]pyridine 4-Methylbenzenesulfonate

CAS Number

153075-10-6

Molecular Formula

C28 H40 O7

Molecular Weight

488.613

Accurate Mass

488.277

SMILES

CCCC(=O)OC1(CC[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@H]3[C@@H](O)C[C@]12C)C(=O)COC(=O)CC

InChI

InChI=1S/C28H40O7/c1-5-7-24(33)35-28(22(31)16-34-23(32)6-2)13-11-20-19-9-8-17-14-18(29)10-12-26(17,3)25(19)21(30)15-27(20,28)4/h14,19-21,25,30H,5-13,15-16H2,1-4H3/t19-,20+,21-,25-,26-,27-,28?/m0/s1

IUPAC

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

Alternate CAS Number

Free Base: 272-14-0

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat