3-Amino-2-(4-(((5aR,6S)-6-methoxy-1,7-dioxo-1,3,4,5a,6,7-hexahydroazeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl)carbamoyl)-1,3-dithietan-2-ylidene)-3-oxopropanoic Acid
Product Code
TRC-A612025-25MG
Product Format
Neat
Molecular Formula
C15 H13 N3 O8 S3
Molecular Weight
459.474
Product Categories
Product Information
Product Data
Analyte Name
3-Amino-2-(4-(((5aR,6S)-6-methoxy-1,7-dioxo-1,3,4,5a,6,7-hexahydroazeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl)carbamoyl)-1,3-dithietan-2-ylidene)-3-oxopropanoic Acid
Molecular Formula
C15 H13 N3 O8 S3
Molecular Weight
459.474
Accurate Mass
458.986
SMILES
CO[C@]1(NC(=O)C2SC(=C(C(=O)N)C(=O)O)S2)[C@H]3SCC4=C(N3C1=O)C(=O)OC4
InChI
InChI=1S/C15H13N3O8S3/c1-25-15(13(24)18-6-4(2-26-10(6)23)3-27-14(15)18)17-8(20)12-28-11(29-12)5(7(16)19)9(21)22/h12,14H,2-3H2,1H3,(H2,16,19)(H,17,20)(H,21,22)/t12?,14-,15+/m1/s1
IUPAC
3-amino-2-[4-[[(4S,5R)-4-methoxy-3,11-dioxo-10-oxa-6-thia-2-azatricyclo[6.3.0.02,5]undec-1(8)-en-4-yl]carbamoyl]-1,3-dithietan-2-ylidene]-3-oxopropanoic acid
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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