Compound C18H39N5O13S

4-amino-2-[4,6-diamino-3-[3-amino-6-(aminomethyl)-5-hydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol;sulfuric acid

CAS: 79645-27-5

Molecular Formula	`C18H39N5O13S`
Molecular Weight	565.6 g/mol
Topological Polar Surface Area	351.0 A2
Hydrogen Bond Donors	12
Hydrogen Bond Acceptors	18
Rotatable Bonds	6
Exact Mass	565.2265
Heavy Atoms	37
Complexity	690.0

Chemical Identifiers

CAS Number	79645-27-5
SMILES	`C1C(C(C(C(C1N)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(CC(C(O3)CN)O)N)N.OS(=O)(=O)O`
InChIKey	`ZEUUPKVZFKBXPW-UHFFFAOYSA-N`

📖 Product Overview

Compound C18H39N5O13S (CAS: 79645-27-5) is a chemical compound with molecular formula C18H39N5O13S and molecular weight 565.6 g/mol. Its IUPAC systematic name is 4-amino-2-[4,6-diamino-3-[3-amino-6-(aminomethyl)-5-hydroxyoxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-6-(hydroxymethyl)oxane-3,5-diol;sulfuric acid. Topological Polar Surface Area 351.0 A2 Hydrogen Bond Donors 12 Hydrogen Bond Acceptors 18 Rotatable Bonds 6 Exact Mass 565.2265 Heavy Atoms 37 Complexity 690.0 InChI Key: ZEUUPKVZFKBXPW-UHFFFAOYSA-N. SMILES: C1C(C(C(C(C1N)OC2C(C(C(C(O2)CO)O)N)O)O)OC3C(CC(C(O3)CN)O)N)N.OS(=O)(=O)O.

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