9,10-anhydroadriamycin
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9,10-anhydroadriamycin
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CAS No:
80996-23-2
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Formula:
C27H27NO10
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Chemical Name:
9,10-anhydroadriamycin
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Synonyms:
9,10-anhydroadriamycin;9,10-anhydrodoxorubicin;DTXSID201001687;ZINC141426825;(7S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,11-dihydroxy-9-(2-hydroxyacetyl)-4-methoxy-7,8-dihydrotetracene-5,12-dione;5,12-Dihydroxy-3-(hydroxyacetyl)-10-methoxy-6,11-dioxo-1,2,6,11-tetrahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside;5,12-Naphthacenedione, 10-((3-amino-2,3,6-trideoxy-alpha-L-lyxo-hexopyranosyl)oxy)-9,10-dihydro-6,11-dihydroxy-8-(hydroxyacetyl)-1-methoxy-, (S)-
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CAS No:
Computed Properties
Molecular Weight:525.5
XLogP3:1.6
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:525.16349606
Monoisotopic Mass:525.16349606
Topological Polar Surface Area:186
Heavy Atom Count:38
Complexity:985
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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