s-[(7R,8R,9S,10R,13S,14S,17R)-10,13-Dimethyl-3-oxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-yl]ethanethioate

Catalog Number

ACM6673978

Product Name

s-[(7R,8R,9S,10R,13S,14S,17R)-10,13-Dimethyl-3-oxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2'-oxolane]-7-yl]ethanethioate

Structure

CAS

6673-97-8

Category

Heterocyclic Organic Compound

Synonyms

SPIROXASONE, Spiroxasone (USAN/INN), CID23141, SC 15983, D05912, 6673-97-8, Spiro(androst-4-ene-17,2(3H)-furan)-3-one, 4,5-dihydro-7alpha-mercapto-, acetate, 26215-59-8, 53421-05-9, Acetic acid, thio-, S-ester with 4,5-dihydro-7alpha-mercaptospiro(androst-4-ene-17,2(3H)-furan)-one, Spiro(androst-4-ene-17,2(3H)-furan)-3-one, 7-(acetylthio)-4,5-dihydro-, (7alpha,17beta)-

IUPAC Name

S-[(7R,8R,9S,10R,13S,14S,17R)-10,13-dimethyl-3-oxospiro[2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-17,2-oxolane]-7-yl] ethanethioate

Molecular Weight

402.59 g/mol

Molecular Formula

C₂₄H₃₄O₃S

Canonical SMILES

CC(=O)SC1CC2=CC(=O)CCC2(C3C1C4CCC5(C4(CC3)C)CCCO5)C

InChI Key

XKCGICBTWRNUCL-KIEAKMPYSA-N

Boiling Point

542.5ºC at 760 mmHg

Flash Point

265.5ºC

Density

1.18g/cm³

Exact Mass

402.22300

H-Bond Acceptor

3

H-Bond Donor

0

MSDS

COA

Spec Sheet