Nombre del analito

(S)-2-((S)-2-((tert-Butoxycarbonyl)amino)-3-methylbutanamido)-3-(4-hydroxyphenyl)propanoic Acid Methyl Ester

Fórmula molecular

C30 H29 N3 O7 S

Peso molecular

575.632

Masa exacta

575.173

SMILES

CSC1=CC2=C(N=CC(=O)N2[C@H]3CC(OC(=O)c4ccc(C)cc4)[C@@H](COC(=O)c5ccc(C)cc5)O3)C(=O)N1C

InChI

InChI=1S/C30H29N3O7S/c1-17-5-9-19(10-6-17)29(36)38-16-23-22(40-30(37)20-11-7-18(2)8-12-20)14-25(39-23)33-21-13-26(41-4)32(3)28(35)27(21)31-15-24(33)34/h5-13,15,22-23,25H,14,16H2,1-4H3/t22?,23-,25-/m1/s1

IUPAC

[(2R,5R)-3-(4-methylbenzoyl)oxy-5-(6-methyl-7-methylsulfanyl-2,5-dioxopyrido[3,4-b]pyrazin-1-yl)oxolan-2-yl]methyl 4-methylbenzoate

Alternar número CAS

Parent isomer: 25518-33-6; 1643778-47-5

Temperatura de almacenamiento

-20°C

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat