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Home > Encyclopedia > [2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate

[2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate

[2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate structure

[2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate 

structure
  • CAS No:

    98910-80-6

  • Formula:

    C34H41NO12

  • Chemical Name:

    [2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate

  • Synonyms:

    N,N-dimethyladriamycin-14-valerate;NNDAV;98910-80-6;NNDAV;N,N-Dimethyladriamycin-14-valerate;DTXSID40912991;2-(4-{[4-(DIMETHYLAMINO)-6-HYDROXY-5-METHYLOXAN-2-YL]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-(1,2,3,4,6,11-hexahydro-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-4-((2,3,6-trideoxy-3-(dimethylamino)-alpha-L-lyxo-hexopyranosyl)oxy)-2-naphthacenyl)-2-oxoethyl ester, (2S-cis)-

[2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate Basic Attributes

655.7 g/mol

655.26287574 g/mol

Characteristics

189 Ų

Drug Information

N,N-dimethyladriamycin-14-valerate

Computed Properties

Molecular Weight:655.7
XLogP3:4.1
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:13
Rotatable Bond Count:11
Exact Mass:655.26287574
Monoisotopic Mass:655.26287574
Topological Polar Surface Area:189
Heavy Atom Count:47
Complexity:1180
Undefined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of [2-[4-[4-(dimethylamino)-6-hydroxy-5-methyloxan-2-yl]oxy-2,5,12-trihydroxy-7-methoxy-6,11-dioxo-3,4-dihydro-1H-tetracen-2-yl]-2-oxoethyl] pentanoate

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