Chemical Compound

Valrubicin

CAS Registry Number 56124-62-0
Valrubicin chemical structure
Primary Record

Valrubicin

In stock
3,868 g
Purity
99.6 %
CAS
56124-62-0

Compound Identifiers & Properties

CAS
56124-62-0
PubChem CID
3794430
SMILES
CCCCC(=O)OCC(=O)C1(CC(C2=C(C1)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4OC)O)OC5CC(C(C(O5)C)O)NC(=O)C(F)(F)F)O
Canonical SMILES
CCCCC(=O)OCC(=O)C1(O)Cc2c(O)c3c(c(O)c2C(OC2CC(NC(=O)C(F)(F)F)C(O)C(C)O2)C1)C(=O)c1c(OC)cccc1C3=O

Names & Synonyms

  • Valrubicin
  • Valstar
  • Antibiotic AD 32
  • Valrubicin [USAN]
  • AC1MXQAY
  • Valstar Preservative Free
  • Neuro_000117
  • MLS002703032
  • UNII-2C6NUM6878
  • Valrubicin [USAN:USP:INN]
  • AD 32
  • CHEMBL1735689
  • HSDB 7288
  • C34H36F3NO13
  • HMS5087F10
  • Trifluoroacetyladriamycin-14-valerate
  • C34-H36-F3-N-O13
  • CID3794430
  • N-Trifluoroacetyladriamycin 14-valerate
  • N-Trifluoroacetyladriamycin-14-valerate
  • NSC 246131
  • NSC-246131
  • N-Trifluoroacetyldoxorubicin 14-valerate
  • SMR001566840
  • FT-0655298
  • 56124-62-0
  • [2-oxo-2-[(2S,4S)-2,5,12-trihydroxy-4-[(2R,4S,5S,6S)-5-hydroxy-6-methyl-4-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]oxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethyl] pentanoate
  • [2-oxo-2-[2,5,12-trihydroxy-4-[5-hydroxy-6-methyl-4-[(2,2,2-trifluoroacetyl)amino]oxan-2-yl]oxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]ethyl] pentanoate
  • Pentanoic acid, 2-[1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-4-[[2,3,6-trideoxy-3-[(trifluoroacetyl)amino]-.alpha.-L-lyxo-hexopyranosyl]oxy]-2-naphthacenyl]-2-oxoethyl ester, (2S-cis)-