(3β,20S)-20-Methyl-pregn-5-ene-3,21-diol 3-Acetate 21-Tosyl


CAS No. : 120664-97-3

(3β,20S)-20-Methyl-pregn-5-ene-3,21-diol 3-Acetate 21-Tosyl,120664-97-3
Product Details
Cat No:R058801
Synonyms:(3β,20S)-20-Methyl-pregn-5-ene-3,21-diol 3-Acetate 21-(4-Methylbenzenesulfonate)
Molecular Formula:C31H44O5S
Molecular Weight:528.748
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Cat No:R058801
Cas No:120664-97-3
Product-Name:(3β,20S)-20-Methyl-pregn-5-ene-3,21-diol 3-Acetate 21-Tosyl
IUPAC Name:[(3S,8S,9S,10R,13S,14S,17R)-10,13-dimethyl-17-[(2S)-1-(4-methylphenyl)sulfonyloxypropan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] acetate
InChI:InChI=1S/C31H44O5S/c1-20-6-9-25(10-7-20)37(33,34)35-19-21(2)27-12-13-28-26-11-8-23-18-24(36-22(3)32)14-16-30(23,4)29(26)15-17-31(27,28)5/h6-10,21,24,26-29H,11-19H2,1-5H3/t21-,24+,26+,27-,28+,29+,30+,31-/m1/s1
InChIKey:YJIVKCVTWWRTED-CIMDZAPNSA-N
SMILES:CC1=CC=C(C=C1)S(=O)(=O)OCC(C)C2CCC3C2(CCC4C3CC=C5C4(CCC(C5)OC(=O)C)C)C
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