Chemical Compound

Doxorubicin 14-valerate

CAS Registry Number 80287-44-1
Doxorubicin 14-valerate chemical structure
Primary Record

Doxorubicin 14-valerate

In stock
3,353 g
Purity
99.4 %
CAS
80287-44-1

Compound Identifiers & Properties

CAS
80287-44-1
PubChem CID
10349017
SMILES
CCCCC(=O)OCC(=O)[C@]1(C[C@@H](C2=C(C1)C(=C3C(=C2O)C(=O)C4=C(C3=O)C=CC=C4OC)O)O[C@H]5C[C@@H]([C@@H]([C@@H](O5)C)O)N)O
Canonical SMILES
CCCCC(=O)OCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=O

Names & Synonyms

  • Doxorubicin 14-valerate
  • Adriamycin 14-valerate
  • UNII-VX84V04LL9
  • RefChem:135731
  • VX84V04LL9
  • DTXSID501026345
  • CID10349017
  • Valrubicin impurity, doxorubicin valerate [USP]
  • CID 10349017
  • 80287-44-1
  • Valrubicin impurity, doxorubicin valerate (USP)
  • Q27292067
  • VALRUBICIN IMPURITY, DOXORUBICIN VALERATE [USP IMPURITY]
  • 2-((2S,4S)-4-((3-Amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl)-2-oxoethyl pentanoate
  • Pentanoic acid, 2-((2S,4S)-4-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-2-naphthacenyl)-2-oxoethyl ester
  • VALRUBICIN IMPURITY, DOXORUBICIN VALERATE (USP IMPURITY)
  • 2-((2S,4S)-4-((3-AMINO-2,3,6-TRIDEOXY-.ALPHA.-L-LYXO-HEXOPYRANOSYL)OXY)-2,5,12-TRIHYDROXY-7-METHOXY-6,11-DIOXO-1,2,3,4,6,11-HEXAHYDROTETRACEN-2-YL)-2-OXOETHYL PENTANOATE
  • PENTANOIC ACID, 2-((2S,4S)-4-((3-AMINO-2,3,6-TRIDEOXY-.ALPHA.-L-LYXO-HEXOPYRANOSYL)OXY)-1,2,3,4,6,11-HEXAHYDRO-2,5,12-TRIHYDROXY-7-METHOXY-6,11-DIOXO-2-NAPHTHACENYL)-2-OXOETHYL ESTER
  • [2-[(2S,4S)-4-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate
  • 2-((2S,4S)-4-(((2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl)-2-oxoethyl pentanoate