Analyte Name

(2S)-7-Amino-2-((2S)-2-(6-amino-2-(4-carboxybutanamido)hexanamido)-6-(4-carboxybutanamido)hexanamido)heptanoic Acid

Molecular Formula

C29 H52 N6 O10

Molecular Weight

644.757

Accurate Mass

644.374

SMILES

NCCCCC[C@H](NC(=O)[C@H](CCCCNC(=O)CCCC(=O)O)NC(=O)C(CCCCN)NC(=O)CCCC(=O)O)C(=O)O

InChI

InChI=1S/C29H52N6O10/c30-17-5-1-2-12-22(29(44)45)35-28(43)21(11-4-7-19-32-23(36)13-8-15-25(38)39)34-27(42)20(10-3-6-18-31)33-24(37)14-9-16-26(40)41/h20-22H,1-19,30-31H2,(H,32,36)(H,33,37)(H,34,42)(H,35,43)(H,38,39)(H,40,41)(H,44,45)/t20?,21-,22-/m0/s1

IUPAC

(2S)-7-amino-2-[[(2S)-2-[[6-amino-2-(4-carboxybutanoylamino)hexanoyl]amino]-6-(4-carboxybutanoylamino)hexanoyl]amino]heptanoic acid

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat