Molecular Identity
Epirubicin Hydrochloride
(7S,9S)-7-[(2R,4S,5R,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione;hydrochloride
PubChem CID: 65348
Epirubicin hydrochloride is an anthracycline. It has a role as an antineoplastic agent.
2D Structure
Properties
C27H30ClNO11
Molecular Formula
580.00
Molecular Weight
g/mol
579.1507
Exact Mass
Da
206
TPSA
May have limited oral absorption
7
H-Bond Donors
12
H-Bond Acceptors
977
Complexity
SMILES
Canonical SMILES
SMILES: CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.ClIsomeric SMILES
SMILES: C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2C[C@@](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(=O)CO)O)N)O.ClSynonyms(20)
Epirubicin hydrochloride56390-09-1Epirubicin HClFarmorubicinaIMI-28NSC-759195WP-69722966TX7J5DTXSID508602975,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-arabino-hexopyranosyl)oxy)-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(hydroxyacetyl)-1-methoxy-, hydrochloride, (8S-cis)-Pharmorubicin PfsRefChem:55118Hydrochloride, EpirubicinIMI28DTXCID001475450
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Epirubicin Hydrochloride
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