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32388-21-9

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Basic Information
CAS No.: 32388-21-9
Name: minimycin
Article Data: 2
Molecular Structure:
Molecular Structure of 32388-21-9 (minimycin)
Formula: C9H11 N O7
Molecular Weight: 245.189
Synonyms: Minimycin;Oxazinomycin
Density: 1.705g/cm3
Melting Point: 165°C (rough estimate)
Boiling Point: °Cat760mmHg
Flash Point: °C
Safety: Poison by intraperitoneal, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx.
PSA: 133.25000
LogP: -2.10560
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Chemistry

Product Name: Minimycin (CAS NO.32388-21-9)


Molecular Formula: C9H11NO7
Molecular Weight: 245.21g/mol
Mol File: 32388-21-9.mol
Density: 1.705 g/cm3
Surface Tension: 85.7 dyne/cm
XLogP3-AA: -2.2
H-Bond Donor: 4
H-Bond Acceptor: 4
Structure Descriptors of Minimycin (CAS NO.32388-21-9):
  IUPAC Name: 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,3-oxazine-2,4-dione
  Canonical SMILES: C1=C(C(=O)NC(=O)O1)C2C(C(C(O2)CO)O)O
  Isomeric SMILES: C1=C(C(=O)NC(=O)O1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
  InChI: InChI=1S/C9H11NO7/c11-1-4-5(12)6(13)7(17-4)3-2-16-9(15)10-8(3)14/h2,4-7,11-13H,1H2,(H,10,14,15)/t4-,5-,6-,7+/m1/s1
  InChIKey: REFHNSOTFKKRAI-GBNDHIKLSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 5mg/kg (5mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 5, Pg. 281, 1981.
mouse LD50 intravenous 50mg/kg (50mg/kg)   "CRC Handbook of Antibiotic Compounds," Vols.1- , Berdy, J., Boca Raton, FL, CRC Press, 1980Vol. 5, Pg. 281, 1981.
mouse LD50 subcutaneous 20mg/kg (20mg/kg)   Journal of Antibiotics. Vol. 25, Pg. 44, 1972.

Safety Profile

Poison by intraperitoneal, subcutaneous, and intravenous routes. When heated to decomposition it emits toxic fumes of NOx.

Specification

 Minimycin , its CAS NO. is 32388-21-9, the synonyms are 5-beta-D-Ribofuranosyl-1,3-oxazine-2,4-dione ; Oxazinomycin ; 2H-1,3-Oxazine-2,4(3H)-dione, 5-beta-D-ribofuranosyl- .