Kasugamycin sulfate (78822-08-9),Kasugamycin sulfate (78822-08-9) Manufacturers & Suppliers,Synthesis,MSDS

Basic information

Name:
KASUGAMYCIN SULFATE
CAS No.:
78822-08-9
Molecular Structure:
Formula:
C₁₄H₂₅N₃O₉•H₂O₄S
Molecular Weight:
477.50
Synonyms:
kasugamycin hemisulfate
Safety Description:
Mildly toxic by ingestion and several other routes. When heated to decomposition it emits very toxic fumes of SO_x and NO_x. See also KASUGAMYCIN; KASUGAMYCIN HYDROCHLORIDE; KASUGAMYCIN PHOSPHATE. Details

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Chemistry

Empirical Formula of Kasugamycin sulfate (CAS NO.78822-08-9): C₂₈H₅₂N₆O₂₂S
Molecular Weight: 856.8045 g/mol
Flash Point: 333.7 °C
Enthalpy of Vaporization: 106.54 kJ/mol
Boiling Point: 628.2 °C at 760 mmHg
Vapour Pressure: 2.04E-18 mmHg at 25 °C
Structure of Kasugamycin sulfate (CAS NO.78822-08-9):

IUPAC Name: 2-Amino-2-[(2R,3S,5S,6R)-5-amino-2-methyl-6-[(2S,3S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyoxan-3-yl]iminoacetic acid ; Sulfuric acid
Canonical SMILES: CC1C(CC(C(O1)OC2C(C(C(C(C2O)O)O)O)O)N)N=C(C(=O)O)N.CC1C(CC(C(O1)OC2C(C(C(C(C2O)O)O)O)O)N)N=C(C(=O)O)N.OS(=O)(=O)O
Isomeric SMILES: C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N.C[C@@H]1[C@H](C[C@@H]([C@H](O1)OC2[C@@H]([C@H](C([C@@H]([C@@H]2O)O)O)O)O)N)N=C(C(=O)O)N.OS(=O)(=O)O
InChI: InChI=1S/2C14H25N3O9.H2O4S/c2*1-3-5(17-12(16)13(23)24)2-4(15)14(25-3)26-11-9(21)7(19)6(18)8(20)10(11)22;1-5(2,3)4/h2*3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);(H2,1,2,3,4)/t2*3-,4+,5+,6?,7+,8+,9-,10+,11?,14-;/m11./s1
InChIKey: NAPCRKAUXHXHCU-JLNGJXGCSA-N

Toxicity Data With Reference

1.	orl-rat LD50:22 g/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
2.	ipr-rat LD50:12 g/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
3.	scu-rat LD50:15,500 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
4.	ivn-rat LD50:4900 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
5.	orl-mus LD50:20,700 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
6.	ipr-mus LD50:10 g/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
7.	scu-mus LD50:12 g/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
8.	ivn-mus LD50:5500 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
9.	scu-dog LD50:10,500 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
10.	ivn-dog LD50:4500 mg/kg	JJANAX Japanese Journal of Antibiotics. 21 (1968),206.
11.	scu-rbt LDL

Safety Profile

Mildly toxic by ingestion and several other routes. When heated to decomposition Kasugamycin sulfate (CAS NO.78822-08-9) emits very toxic fumes of SO_x and NO_x. See also KASUGAMYCIN; KASUGAMYCIN HYDROCHLORIDE; KASUGAMYCIN PHOSPHATE.

Specification

Kasugamycin sulfate , its cas register number is 78822-08-9. It also can be called D-chiro-Inositol, 3-O-(2-amino-4-((carboxyiminomethyl)amino)-2,3,4,6-tetradeoxy-alpha-D-arabino-hexopyranosyl)-, sulfate (1:1) (salt) .