Vitas-M small molecule compound
(1S,5R)-3-[2-(5-methoxy-1H-indol-3-yl)-2-oxoethyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL526643
SMILES COc1ccc2c(c1)c(c[nH]2)C(=O)CN1C[C@H]2C[C@@H](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 C22H23N3O3 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3/c1-28-16-5-6-19-17(8-16)18(9-23-19)21(26)13-24-10-14-7-15(12-24)20-3-2-4-22(27)25(20)11-14/h2-6,8-9,14-15,23H,7,10-13H2,1H3/t14-,15+/m1/s1InChIKey
DIBXVFCFCQWWDD-CABCVRRESA-NSynonyms
1212443-81-6(1~(S)9~(R))11(2(5methoxy1~(H)indol3yl)2oxoethyl)711diazatricyclo(7310^(27))trideca24dien6one
(1R5S)3(2(5methoxy1Hindol3yl)2oxoethyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(2(5methoxy1Hindol3yl)2oxoethyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
1212443816
1795803
COc1ccc2c(c1)c(c(nH)2)C(=O)CN1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC22H23N3O3c12816561917(816)18(92319)21(26)13241014715(1224)2032422(27)25(20)1114h2689141523H71013H21H3t1415+m1s1
MFCD03005672
ZINC000058979823
ZINC58979823
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