Products 63521-85-7

CAS 63521-85-7 appears in our catalog under these names: Esorubicin, 4′-Deoxydoxorubicin. Offered by: TargetMol, MedChemExpress. Available pack sizes: 25mg, 50mg, 100mg, Get quote.

Esorubicin
TargetMol
  • size: 25mg, 50mg, 100mg
  • Variants: 3
from 29659.30
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4′-Deoxydoxorubicin
MedChemExpress
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  • Variants: 1
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Structural formula: {0} (CAS {1})

(7S,9S)-7-[(2S,4R,6S)-4-amino-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione (CAS 63521-85-7) is a chemical compound with the molecular formula C27H29NO10 and a molecular weight of 527.5 g/mol. IUPAC name: (7S,9S)-7-[(2S,4R,6S)-4-amino-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione. InChIKey: ITSGNOIFAJAQHJ-BMFNZSJVSA-N.

Identity
Molecular formulaC27H29NO10
Molecular weight527.5 g/mol
IUPAC name(7S,9S)-7-[(2S,4R,6S)-4-amino-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
InChIKeyITSGNOIFAJAQHJ-BMFNZSJVSA-N
SMILESC[C@H]1C[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

Computed by PubChem (NCBI)

Synonyms: Esorubicin, 4'-Deoxyadriamycin, 4'-Deoxydoxorubicin, Esorubicina, Esorubicine, Esorubicinum, 4-desoxydoxorubicin, Deoxyadriamycin, Esorubicin [INN], Esorubicina [INN-Spanish]
Isomers (same molecular formula)
(7S,9S)-9-acetyl-7-[(2R,4R,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione C27H29NO10
(7S,9S)-9-acetyl-7-[(2R,4S,5R,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione C27H29NO10
(7S,9S)-9-acetyl-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione C27H29NO10
[6-[(3,4,5-trimethoxybenzoyl)oxymethyl]-2-pyridinyl]methyl 3,4,5-trimethoxybenzoate C27H29NO10
(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9-dihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione C27H29NO10