D-chiro-Inositol,3-O-[2-amino-4-[(carboxyiminomethyl)amino]-2,3,4,6-tetradeoxy-a-D-arabino-hexopyranosyl]-,hydrochloride (1:1)

The CAS register number of Kasumin is 19408-46-9. It also can be called as Kasugamycin hydrochloride and the IUPAC name about this chemical is 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 hydrochloride. The molecular formula about this chemical is C₁₄H₂₅N₃O₉^.HCl and the molecular weight is 415.82. It belongs to the Fungicide. When you are using it, you need avoid contact with skin and eyes and do not breathe dust. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Physical properties about Kasumin are: (1)# of Rule of 5 Violations: 2; (2)#H bond acceptors: 12; (3)#H bond donors: 10; (4)#Freely Rotating Bonds: 10; (5)Polar Surface Area: 218.81Ų; (6)Flash Point: 319.3 °C; (7)Enthalpy of Vaporization: 103.11 kJ/mol; (8)Boiling Point: 604.4 °C at 760 mmHg; (9)Vapour Pressure: 3.93E-17 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.OC(=O)C(=N)N[C@H]2C[C@H](N)[C@@H](O[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)[C@@H]1O)O[C@@H]2C
(2)InChI: InChI=1/C14H25N3O9.ClH/c1-3-5(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;/h3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);1H/t3-,4+,5+,6-,7+,8+,9-,10+,11+,14-;/m1./s1
(3)InChIKey: ZDRBJJNXJOSCLR-NZXABURVBB
(4)Std. InChI: InChI=1S/C14H25N3O9.ClH/c1-3-5(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;/h3-11,14,18-22H,2,15H2,1H3,(H2,16,17)(H,23,24);1H/t3-,4+,5+,6-,7+,8+,9-,10+,11+,14-;/m1./s1
(5)Std. InChIKey: ZDRBJJNXJOSCLR-NZXABURVSA-N

The toxicity data is as follows: