Virginiamycin S1
Product Code
TRC-V673813
CAS Number
Product Format
Neat
Molecular Formula
C43 H49 N7 O10
Molecular Weight
823.89
Product Categories
TRC, Antibacterial, Pharmaceutical Reference Standards, Macrolides, Antibacterial, Macrolides, Pharmaceutical and Veterinary Residue Reference Materials , Pharmaceutical, Veterinary Compound & Metabolite Reference Materials
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Virginiamycin S1
CAS Number
23152-29-6
Molecular Formula
C43 H49 N7 O10
Molecular Weight
823.89
Accurate Mass
823.3541
SMILES
O=C1N2[C@](C(=O)N[C@H](C(=O)O[C@H](C)[C@H](NC(=O)C3=C(O)C=CC=N3)C(=O)N[C@H](CC)C(=O)N4[C@](C(=O)N(C)[C@H]1CC5=CC=CC=C5)(CCC4)[H])C6=CC=CC=C6)(CC(=O)CC2)[H]
InChI
InChI=1S/C43H49N7O10/c1-4-29-40(56)49-21-12-17-30(49)41(57)48(3)32(23-26-13-7-5-8-14-26)42(58)50-22-19-28(51)24-31(50)37(53)47-35(27-15-9-6-10-16-27)43(59)60-25(2)34(38(54)45-29)46-39(55)36-33(52)18-11-20-44-36/h5-11,13-16,18,20,25,29-32,34-35,52H,4,12,17,19,21-24H2,1-3H3,(H,45,54)(H,46,55)(H,47,53)/t25-,29-,30+,31+,32+,34+,35+/m1/s1
IUPAC
N-[(3S,6S,12R,15S,16R,22S)-3-benzyl-12-ethyl-4,16-dimethyl-2,5,11,14,18,21,24-heptaoxo-19-phenyl-17-oxa-1,4,10,13,20-pentazatricyclo[20.4.0.0^{6,10}]hexacosan-15-yl]-3-hydroxy-pyridine-2-carboxamide
Product Data
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
Purity
>95% (HPLC)