Vitas-M small molecule compound
benzyl 2-{[(5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}pyrrolidine-1-carboxylate
Catalog ID
STL526488
SMILES O=C(C1CCCN1C(=O)OCc1ccccc1)N1C[C@H]2CC(C1)c1n(C2)c(=O)ccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H27N3O4 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4/c28-22-10-4-8-20-19-12-18(14-27(20)22)13-25(15-19)23(29)21-9-5-11-26(21)24(30)31-16-17-6-2-1-3-7-17/h1-4,6-8,10,18-19,21H,5,9,11-16H2/t18-,19?,21?/m0/s1InChIKey
CJGDSISGEYIGNY-JSOIOWGOSA-NSynonyms
benzyl2(((5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonyl)pyrrolidine1carboxylate
benzyl2((1R5S)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carbonyl)pyrrolidine1carboxylate
InChI=1SC24H27N3O4c2822104820191218(1427(20)22)1325(1519)23(29)21951126(21)24(30)3116176213717h146810181921H591116H2t1819?21?m0s1
MFCD02925183
O=C(C1CCCN1C(=O)OCc1ccccc1)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
ZINC001772492391
ZINC001772492392
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