(alphaS,6R,7S)-6,7,8,8a-tetrahydro-6,7,8a-trihydroxy-2-(methylthio)-alpha-[[(phenylmethoxy)carbonyl]amino]-imidazo[4,5-b]azepine-4(5H)-hexanoic Acid Phenylmethyl Ester
Product Code
TRC-T294518-100MG
CAS Number
Product Format
Neat
Molecular Formula
C29 H36 N4 O7 S
Molecular Weight
584.684
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
(alphaS,6R,7S)-6,7,8,8a-tetrahydro-6,7,8a-trihydroxy-2-(methylthio)-alpha-(((phenylmethoxy)carbonyl)amino)-imidazo(4,5-b)azepine-4(5H)-hexanoic Acid Phenylmethyl Ester
CAS Number
2089036-71-3
Molecular Formula
C29 H36 N4 O7 S
Molecular Weight
584.684
Accurate Mass
584.23
SMILES
CSC1=NC2(O)C[C@H](O)[C@H](O)CN(CCCC[C@H](NC(=O)OCc3ccccc3)C(=O)OCc4ccccc4)C2=N1
InChI
InChI=1S/C29H36N4O7S/c1-41-27-31-26-29(38,32-27)16-23(34)24(35)17-33(26)15-9-8-14-22(25(36)39-18-20-10-4-2-5-11-20)30-28(37)40-19-21-12-6-3-7-13-21/h2-7,10-13,22-24,34-35,38H,8-9,14-19H2,1H3,(H,30,37)/t22-,23-,24+,29?/m0/s1
IUPAC
benzyl (2S)-6-[(6R,7S)-6,7,8a-trihydroxy-2-methylsulfanyl-5,6,7,8-tetrahydroimidazo[4,5-b]azepin-4-yl]-2-(phenylmethoxycarbonylamino)hexanoate
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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