Analyte Name

(6R,7S,8a-rac)-(4'-Desamino) Glucosepane

Molecular Formula

C18 H31 N5 O6

Molecular Weight

413.469

Accurate Mass

413.227

SMILES

N[C@@H](CCCCN1C[C@@H](O)[C@@H](O)CC2N=C(NCCCCC(=O)O)N=C12)C(=O)O

InChI

InChI=1S/C18H31N5O6/c19-11(17(28)29)5-2-4-8-23-10-14(25)13(24)9-12-16(23)22-18(21-12)20-7-3-1-6-15(26)27/h11-14,24-25H,1-10,19H2,(H,20,21)(H,26,27)(H,28,29)/t11-,12?,13-,14+/m0/s1

IUPAC

(2S)-2-amino-6-[(6R,7S)-2-(4-carboxybutylamino)-6,7-dihydroxy-6,7,8,8a-tetrahydro-5H-imidazo[4,5-b]azepin-4-yl]hexanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat