Vitas-M small molecule compound
[6-bromo-1-(carboxymethyl)-1H-indol-3-yl][(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetic acid
Catalog ID
STL535701
SMILES Brc1ccc2c(c1)n(CC(=O)O)cc2C(N1C[C@@H]2C[C@H](C1)c1n(C2)c(=O)ccc1)C(=O)O
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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 C23H22BrN3O5 MW 500.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O5/c24-15-4-5-16-17(11-25(12-21(29)30)19(16)7-15)22(23(31)32)26-8-13-6-14(10-26)18-2-1-3-20(28)27(18)9-13/h1-5,7,11,13-14,22H,6,8-10,12H2,(H,29,30)(H,31,32)/t13-,14+,22?/m1/s1InChIKey
BNDXYQPZYYJTGI-NSCHKWSVSA-NSynonyms
(6bromo1(carboxymethyl)1Hindol3yl)((1S5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)aceticacid
2(6bromo1(carboxymethyl)1Hindol3yl)2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)aceticacid
Brc1ccc2c(c1)n(CC(=O)O)cc2C(N1C(C@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)C(=O)O
InChI=1SC23H22BrN3O5c2415451617(1125(1221(29)30)19(16)715)22(23(31)32)26813614(1026)1821320(28)27(18)913h15711131422H681012H2(H2930)(H3132)t1314+22?m1s1
ZINC000100792766
ZINC000100792767
Check stock
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