Products 98983-21-2

CAS 98983-21-2 is the registry number for N-Benzyladriamycin-14-Valerate (AD 198). Offered by: Chemat Brand. Available pack sizes: on request.

N-Benzyladriamycin-14-Valerate (AD 198)
Chemat Brand
  • size: on request
  • Variants: 1
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Structural formula: {0} (CAS {1})

[2-[(2S,4S)-4-[(2R,4S,5S,6S)-4-(benzylamino)-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 (CAS 98983-21-2) is a chemical compound with the molecular formula C39H43NO12 and a molecular weight of 717.8 g/mol. IUPAC name: [2-[(2S,4S)-4-[(2R,4S,5S,6S)-4-(benzylamino)-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. InChIKey: IUKSGXMOHXEUJY-YWVRLZQXSA-N.

Identity
Molecular formulaC39H43NO12
Molecular weight717.8 g/mol
IUPAC name[2-[(2S,4S)-4-[(2R,4S,5S,6S)-4-(benzylamino)-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
InChIKeyIUKSGXMOHXEUJY-YWVRLZQXSA-N
SMILESCCCCC(=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)NCC6=CC=CC=C6)O

Computed by PubChem (NCBI)

Synonyms: N-Benzyladriamycin-14-valerate, N-Benzyladriamycin-14-Valerate (AD 198)