Product Name
Daptomycin-d5
Product Number
C4X-137848
Certificate of Analysis (COA)
IUPAC Name
(3S)-3-(2S)-4-amino-2-(2S)-2-(decanoylamino)-3-(2,4,5,6,7-pentadeuterio-1H-indol-3-yl)propanoylamino-4-oxobutanoylamino-4-(3S,6S,9R,15S,18R,21S,24S,30S,31R)-3-2-(2-aminophenyl)-2-oxoethyl-24-(3-aminopropyl)-15,21-bis(carboxymethyl)-6-(2R)-1-carboxypropan-2-yl-9-(hydroxymethyl)-18,31-dimethyl-2,5,8,11,14,17,20,23,26,29-decaoxo-1-oxa-4,7,10,13,16,19,22,25,28-nonazacyclohentriacont-30-ylamino-4-oxobutanoic acid
InChI Key
DOAKLVKFURWEDJ-WJGQFOGUSA-N
SMILES
2HC1=C(C(=C2C(=C12H)C(=C(N2)2H)CC@@H(C(=O)NC@@H(CC(=O)N)C(=O)NC@@H(CC(=O)O)C(=O)NC@H3C@H(OC(=O)C@@H(NC(=O)C@@H(NC(=O)C@H(NC(=O)CNC(=O)C@@H(NC(=O)C@H(NC(=O)C@@H(NC(=O)C@@H(NC(=O)CNC3=O)CCCN)CC(=O)O)C)CC(=O)O)CO)C@H(C)CC(=O)O)CC(=O)C4=CC=CC=C4N)C)NC(=O)CCCCCCCCC)2H)2H
