17-(3/'-thiophenyl)androstane-3,14-diol 3-glucopyranoside


CAS No. : 131073-99-9

17-(3/
Product Details
Cat No:M115947
Synonyms:17-(3/'-thiophenyl)androstane-3,14-diol 3-glucopyranoside
Molecular Formula:C31H46O7S
Molecular Weight:562.762
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Cat No:M115947
Cas No:131073-99-9
Product-Name:17-(3/'-thiophenyl)androstane-3,14-diol 3-glucopyranoside
IUPAC Name:3-[(3S,5R,8R,9S,10S,13R,14S,17R)-14-hydroxy-10,13-dimethyl-3-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]cyclohexa-2,4-diene-1-thione
InChI:InChI=1S/C31H46O7S/c1-29-11-8-19(37-28-27(35)26(34)25(33)24(16-32)38-28)15-18(29)6-7-23-22(29)9-12-30(2)21(10-13-31(23,30)36)17-4-3-5-20(39)14-17/h3-4,14,18-19,21-28,32-36H,5-13,15-16H2,1-2H3/t18-,19+,21-,22+,23-,24-,25-,26+,27-,28?,29+,30-,31+/m1/s1
InChIKey:IHIRMPVEMZARQI-KVQHSJIPSA-N
SMILES:CC12CCC(CC1CCC3C2CCC4(C3(CCC4C5=CC(=S)CC=C5)O)C)OC6C(C(C(C(O6)CO)O)O)O
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