Chemical Compound

12-Thiocalanolide B

CAS Registry Number 183791-90-4
12-Thiocalanolide B chemical structure
Primary Record

12-Thiocalanolide B

In stock
1,887 g
Purity
98.6 %
CAS
183791-90-4

Compound Identifiers & Properties

CAS
183791-90-4
PubChem CID
463382
SMILES
CCCC1=CC(=O)OC2=C1C3=C(C=CC(O3)(C)C)C4=C2[C@H]([C@H]([C@@H](O4)C)C)S
Canonical SMILES
CCCc1cc(=O)oc2c3c(c4c(c12)OC(C)(C)C=C4)O[C@@H](C)[C@H](C)[C@@H]3S

Names & Synonyms

  • 12-Thiocalanolide B
  • Calanolide B deriv.
  • RefChem:78296
  • AC1LA7YN
  • DTXSID70171478
  • CHEMBL345100
  • DTXCID1093969
  • NSC692291
  • tetramethyl-propyl-sulfanyl-[?]one
  • CID463382
  • 183791-90-4
  • 3,3-Dimethyl-3-sila-1-oxacyclohexan
  • NSC-692291
  • J790.894F
  • 2H,6H,10H-Benzo(1,2-b:3,4-b':5,6-b'')tripyran-2-one, 11,12-dihydro-12-mercapto-6,6,10,11-tetramethyl-4-propyl-, (10S-(10alpha,11beta,12beta))-
  • (16S,17S,18S)-10,10,16,17-tetramethyl-6-propyl-18-sulfanyl-3,9,15-trioxatetracyclo[12.4.0.02,7.08,13]octadeca-1(14),2(7),5,8(13),11-pentaen-4-one
  • (10S)-11,12-Dihydro-4-propyl-12alpha-mercapto-6,6,10beta,11alpha-tetramethyl-2H,6H,10H-benzo[1,2-b:3,4-b :5,6-b ]tripyran-2-one
  • (10S,11S,12S)-6,6,10,11-Tetramethyl-4-propyl-12-sulfanyl-11,12-dihydro-2H,6H,10H-benzo[1,2-b:3,4-b':5,6-b'']tripyran-2-one
  • (10S,11S,12S)-6,6,10,11-TETRAMETHYL-4-PROPYL-12-SULFANYL-6,10,11,12-TETRAHYDRO-2H-1,5,9-TRIOXATRIPHENYLEN-2-ONE
  • (16S,17S,18S)-10,10,16,17-tetramethyl-6-propyl-18-sulfanyl-3,9,15-trioxatetracyclo(12.4.0.02,7.08,13)octadeca-1(14),2(7),5,8(13),11-pentaen-4-one
  • 2H,6H,10H-Benzo[1,2-b:3,4-b':5,6-b'']tripyran-2-one, 11,12-dihydro-12-mercapto-6,6,10,11-tetramethyl-4-propyl-, [10S-(10.alpha.,11.beta.,12.beta.)]-