4-Amino-2,5-dihydro-2-thioxo-1H-1,5-benzodiazepine-3-carboxylic Acid Ethyl Ester
Product Code
TRC-A605230
CAS Number
Product Format
Neat
Molecular Formula
C25 H40 O9
Molecular Weight
484.58
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- Product Name: 4-Amino-2,5-dihydro-2-thioxo-1H-1,5-benzodiazepine-3-carboxylic Acid Ethyl Ester
- Product Code: TRC-A605230
- CAS Number: 52046-77-2
- Brand: TRC
Product Information
Chemical Data
Analyte Name
4-Amino-2,5-dihydro-2-thioxo-1H-1,5-benzodiazepine-3-carboxylic Acid Ethyl Ester
CAS Number
52046-77-2
Molecular Formula
C25 H40 O9
Molecular Weight
484.58
Accurate Mass
484.267
SMILES
COCOc1c(OC)cc(OC)c2C(=O)C(C)C(CC[C@H](C)[C@H](OC)[C@H](C)[C@H](CO)OC)Oc12
InChI
InChI=1S/C25H40O9/c1-14(23(32-8)16(3)20(12-26)31-7)9-10-17-15(2)22(27)21-18(29-5)11-19(30-6)24(25(21)34-17)33-13-28-4/h11,14-17,20,23,26H,9-10,12-13H2,1-8H3/t14-,15?,16+,17?,20-,23-/m0/s1
IUPAC
2-[(3S,4S,5S,6R)-7-hydroxy-4,6-dimethoxy-3,5-dimethylheptyl]-5,7-dimethoxy-8-(methoxymethoxy)-3-methyl-2,3-dihydrochromen-4-one
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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