Vitas-M small molecule compound
(1R,5R)-3-[2-hydroxy-3-(2-methyl-1-oxo-1,2,3,4-tetrahydro-9H-beta-carbolin-9-yl)propyl]-8-oxo-1,3,4,5,6,8-hexahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3-ium
Catalog ID
STL553167
SMILES OC(Cn1c2C(=O)N(C)CCc2c2c1cccc2)C[NH+]1C[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 C26H31N4O3 MW 447.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O3/c1-27-10-9-21-20-5-2-3-6-23(20)30(25(21)26(27)33)16-19(31)15-28-12-17-11-18(14-28)22-7-4-8-24(32)29(22)13-17/h2-8,17-19,31H,9-16H2,1H3/p+1/t17-,18+,19?/m0/s1InChIKey
JVMHZMCCBNIUKG-PAMZHZACSA-OSynonyms
(1R5R)3(2hydroxy3(2methyl1oxo1234tetrahydro9Hbetacarbolin9yl)propyl)8oxo134568hexahydro2H15methanopyrido(12a)(15)diazocin3ium
135640888
9(2hydroxy3((1~(R)9~(R))6oxo7aza11azoniatricyclo(7310^(27))trideca24dien11yl)propyl)2methyl34dihydropyrido(34b)indol1one
InChI=1SC26H30N4O3c1271092120523623(20)30(25(21)26(27)33)1619(31)152812171118(1428)2274824(32)29(22)1317h28171931H916H21H3p+1t1718+19?m0s1
ZINC000001323338
ZINC000001323339
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