Analytenname

1-(4-Chlorophenyl)-5-[6-[(4-[(4-chlorophenyl)amino]-6-[(1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl]-1,3,5-triazin-2-yl)amino]hexyl]biguanide D-Gluconic Acid Salt

CAS-Nummer

3046108-31-7

Molekularformel

C28H38Cl2N10O5 • C6H12O7

Molekulargewicht

861.73

Genaue Masse

860.3

SMILES

N=C(NC(NCCCCCCNC1=NC(NC2=CC=C(Cl)C=C2)=NC([C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)=N1)=N)NC3=CC=C(Cl)C=C3.OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O

InChI

InChI=1S/C28H38Cl2N10O5.C6H12O7/c29-16-5-9-18(10-6-16)35-26(32)39-25(31)33-13-3-1-2-4-14-34-27-37-24(23(45)22(44)21(43)20(42)15-41)38-28(40-27)36-19-11-7-17(30)8-12-19;7-1-2(8)3(9)4(10)5(11)6(12)13/h5-12,20-23,41-45H,1-4,13-15H2,(H5,31,32,33,35,39)(H2,34,36,37,38,40);2-5,7-11H,1H2,(H,12,13)/t20-,21-,22+,23-;2-,3-,4+,5-/m11/s1

IUPAC

1-[amino-(4-chloroanilino)methylidene]-2-[6-[[4-(4-chloroanilino)-6-[(1S,2R,3R,4R)-1,2,3,4,5-pentahydroxypentyl]-1,3,5-triazin-2-yl]amino]hexyl]guanidine;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid

Lagertemperatur

-20°C

Versandtemperatur

Room Temperature

Herkunftsland

CANADA

Produkttyp

Impurity

Produktformat

Neat

API-Familie

Chlorhexidine