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| CAS No.: | 102647-16-5 |
|---|---|
| Name: | A 64922 |
| Molecular Structure: | |
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| Formula: | C58H84 O26 |
| Molecular Weight: | 1197.42 |
| Synonyms: | AntibioticA 649; NSC 38270 |
| Density: | 1.41g/cm3 |
| Boiling Point: | 1151.2°C at 760 mmHg |
| Flash Point: | 310.4°C |
| Safety: | Poison by subcutaneous and intraperitoneal routes. Human mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. See also OLIVOMYCIN; OLIVOMYCIN A. |
| PSA: | 359.34000 |
| LogP: | 1.87410 |
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Chemistry
Product Name: Antibiotic A-649 (CAS NO.102647-16-5)
Molecular Formula: C58H84O26
Molecular Weight: 1197.42g/mol
Mol File: 102647-16-5.mol
Boiling point: 1151.2 °C at 760 mmHg
Flash Point: 310.4 °C
Density: 1.41 g/cm3
Surface Tension: 69.1 dyne/cm
Enthalpy of Vaporization: 177.99 kJ/mol
XLogP3-AA: 3
H-Bond Donor: 8
H-Bond Acceptor: 26
Structure Descriptors of Antibiotic A-649 (CAS NO.102647-16-5):
IUPAC Name: [(2S,3S,4S,6S)-6-[(2R,3R,4R,6S)-6-[(2R,3R,4R,6S)-6-[[(2S,3S)-6-[(2S,4R,5S,6R)-4-acetyloxy-5-[(2R,4R,5R,6R)-4-hydroxy-5-methoxy-6-methyloxan-2-yl]oxy-6-methyloxan-2-yl]oxy-3-[(1S,3S,4R)-3,4-dihydroxy-1-methoxy-2-oxopentyl]-8,9-dihydroxy-1-oxo-3,4-dihydro-2H-anthracen-2-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]oxy-3-hydroxy-2-methyloxan-4-yl]oxy-4-hydroxy-2,4-dimethyloxan-3-yl]2-methylpropanoate
Toxicity Data With Reference
| 1. | cyt-hmn-leu:15 µg/L | CNREA8 Cancer Research. 26 (1966),2437. | ||
| 2. | ipr-mus LD50:5474 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . | ||
| 3. | scu-mus LD50:3861 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . |
Safety Profile
Poison by subcutaneous and intraperitoneal routes. Human mutation data reported. When heated to decomposition it emits acrid smoke and irritating fumes. See also OLIVOMYCIN; OLIVOMYCIN A.
Specification
Antibiotic A-649 , its CAS NO. is 102647-16-5, the synonyms are A 64922 ; A-649 ; Bristol A-649 ; C-1228 ; NSC 38270 ; Olivomycin D, 3(sup B)-O-(2',6-dideoxy-3-C-methyl-4-O-(2-methyl-1-oxopropyl)-alpha-L-arabino-hexopyranosyl)- .