Chemical Compound

calyculin A

CAS Registry Number 101932-71-2
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calyculin A chemical structure
Primary Record

calyculin A

In stock
9,549 g
Purity
98.9 %
CAS
101932-71-2

Compound Identifiers & Properties

CAS
101932-71-2
PubChem CID
71299719
SMILES
CC1C(CC2(C(C(C(O2)C(CC(C(C)C(C(C)/C=C(/C)\C(=C\C=C\C(=C\C#N)\C)\C)O)O)OC)OP(=O)(O)O)(C)C)OC1C/C=C\C3=COC(=N3)C(C)CCNC(=O)C(C(C(COC)N(C)C)O)O)O
Canonical SMILES
COCC(C(O)C(O)C(=O)NCCC(C)c1nc(/C=C\CC2OC3(CC(O)C2C)OC(C(CC(O)C(C)C(O)C(C)/C=C(C)\C(C)=C\C=C\C(C)=C\C#N)OC)C(OP(=O)(O)O)C3(C)C)co1)N(C)C

Names & Synonyms

  • calyculin A
  • hemicalyculin A
  • (-)-calyculin A
  • UNII-7D07U14TK3
  • CCRIS 3706
  • C50H81N4O15P
  • C50-H81-N4-O15-P
  • 101932-71-2
  • L-Ribonamide, N-[(3S)-3-[4-[(1E)-3-[(2R,3R,5R,7S,8S,9R)-2-[(1S,3S,4S,5R,6R,7E,9E,11E,13Z)-14-cyano-3,5-dihydroxy-1-methoxy-4,6,8,9,13-pentamethyl-7,9,11,13-tetradecatetraenyl]-9-hydroxy-4,4,8-trimethyl-3-(phosphonooxy)-1,6-dioxaspiro[4.5]dec-7-yl]-1-prope