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  • 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

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

CAS
6673-97-8
Catalog Number
ACM6673978
Category
Other Products
Molecular Weight
402.59 g/mol
Molecular Formula
C24H34O3S

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Specification

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
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
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