(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid
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![(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/2049f767bd244905b9c49a99e80b77a5.png "(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid")
(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid
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CAS No:
97583-07-8
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Formula:
C27H29NO11
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Chemical Name:
(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid
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Synonyms:
1-Naphthacenecarboxylic acid,4-[(3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-,(1R,2R,4S)-;1-Naphthacenecarboxylic acid,4-[(3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-,[1R-(1α,2β,4β)]-;(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid;Carbolbicin;D 788-1;Carborubicin;Antibiotic D 788-1;163891-88-1
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CAS No:
Description
ChEBI: An anthracycline antibiotic that is 13-deoxycarminomycin substituted at position 10 by a carboxy group.
10-carboxy-13-deoxycarminomycin is an anthracycline antibiotic that is 13-deoxycarminomycin substituted at position 10 by a carboxy group. It is an aminoglycoside, an anthracycline antibiotic, a deoxy hexoside, a monosaccharide derivative, a hydroxy monocarboxylic acid and a member of p-quinones. It derives from a carminomycin. It is a tautomer of a 10-carboxy-13-deoxycarminomycin zwitterion.
(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid Basic Attributes
543.525
543.52
Computed Properties
Molecular Weight:543.5
XLogP3:0.2
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:4
Exact Mass:543.17406074
Monoisotopic Mass:543.17406074
Topological Polar Surface Area:217
Heavy Atom Count:39
Complexity:993
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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(1R,2R,4S)-4-[(3-Amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-2-ethyl-1,2,3,4,6,11-hexahydro-2,5,7,12-tetrahydroxy-6,11-dioxo-1-naphthacenecarboxylic acid
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