Doxorubicinol

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Names

[ CAS No. ]:
54193-28-1

[ Name ]:
Doxorubicinol

[Synonym ]:
14-hydroxydaunomycinone
adriamycinaglycone
8-glycoloyl-7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-1-methoxy-5,12-Naphthacenedione
doxorubicin aglycone
Doxorubicinol
Adriamycin-aglycon
(1S,3S)-3-[(1S)-1,2-Dihydroxyethyl]-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranoside
Epirubicin aglycone
doxorubicin hydroxyaglycone
5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxy-α-L-lyxo-hexopyranosyl)oxy]-8-[(1S)-1,2-dihydroxyethyl]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-, (8S,10S)-
Epirubicin aglycon
Doxorubicinone
13-dihydrodoxorubicin

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
828.7±65.0 °C at 760 mmHg

[ Molecular Formula ]:
C27H31NO11

[ Molecular Weight ]:
545.54

[ Flash Point ]:
455.0±34.3 °C

[ Exact Mass ]:
545.189697

[ PSA ]:
209.23000

[ LogP ]:
2.01

[ Vapour Pressure ]:
0.0±3.2 mmHg at 25°C

[ Index of Refraction ]:
1.717

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QI9326000
CHEMICAL NAME :
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-10-((3-amino-2,3,6-trideoxy-alpha -L-lyxo- hexopyranosyl)oxy)-8-(1,2-dihdyroxyethyl)-1-methoxy-6 ,8,11-trihydroxy-, (8S-(8-alpha,8(R*), 10-alpha))-
CAS REGISTRY NUMBER :
54193-28-1
LAST UPDATED :
199706
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C27-H31-N-O11
MOLECULAR WEIGHT :
545.59

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
DNA damage
TEST SYSTEM :
Rodent - mouse Leukocyte
DOSE/DURATION :
26900 nmol/L
REFERENCE :
CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 41,1006,1981

Precursor & DownStream

Precursor

DownStream

  • Doxorubicin hydrochloride

Related Compounds

  • doxorubicinol
  • DOXORUBICINOL AGLYCONE
  • Doxorubicinol hydrochloride
  • Doxorubicinol hydrochloride
  • 7-Deoxy Doxorubicinol Aglycone
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-[(4-Fluorophenyl)methyl]pent-4-enoic acid
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 2-(4-chlorophenoxy)-2-methyl-N-((1-(pyrazin-2-yl)piperidin-4-yl)methyl)propanamide
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine