Products 70287-21-7

CAS 70287-21-7 is the registry number for Pirarubicin Impurity 4. Offered by: Chemat Brand. Available pack sizes: on request.

Pirarubicin Impurity 4
Chemat Brand
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  • Variants: 1
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Structural formula: {0} (CAS {1})

(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2S)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione (CAS 70287-21-7) is a chemical compound with the molecular formula C32H37NO12 and a molecular weight of 627.6 g/mol. IUPAC name: (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2S)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione. InChIKey: KMSKQZKKOZQFFG-HSUXVGOQSA-N.

Identity
Molecular formulaC32H37NO12
Molecular weight627.6 g/mol
IUPAC name(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2S)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
InChIKeyKMSKQZKKOZQFFG-HSUXVGOQSA-N
SMILESC[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[C@H]6CCCCO6

Computed by PubChem (NCBI)

Synonyms: Therarubicin (TN), Pirarubicin(THP)?, Pirarubicin (JP17/INN), orb1224138, KMSKQZKKOZQFFG-HSUXVGOQSA-N
Related forms of this compound
(7S,9S)-7-[(2R,4S,5S,6S)-4-amino-6-methyl-5-[(2R)-oxan-2-yl]oxyoxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione C32H37NO12