Vitas-M small molecule compound
4-[(3-{carboxy[(1S,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-1H-indol-6-yl)amino]-4-oxobutanoic acid
Catalog ID
STL535861
SMILES OC(=O)CCC(=O)Nc1ccc2c(c1)[nH]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 C25H26N4O6 MW 478.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N4O6/c30-21(6-7-23(32)33)27-16-4-5-17-18(10-26-19(17)9-16)24(25(34)35)28-11-14-8-15(13-28)20-2-1-3-22(31)29(20)12-14/h1-5,9-10,14-15,24,26H,6-8,11-13H2,(H,27,30)(H,32,33)(H,34,35)/t14-,15+,24?/m1/s1InChIKey
HCNSAQHEJBVFLS-JTTBUGBHSA-NSynonyms
4((3(carboxy((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)1Hindol6yl)amino)4oxobutanoicacid
4((3(carboxy((1S5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)1Hindol6yl)amino)4oxobutanoicacid
InChI=1SC25H26N4O6c3021(6723(32)33)2716451718(102619(17)916)24(25(34)35)281114815(1328)2021322(31)29(20)1214h1591014152426H681113H2(H2730)(H3233)(H3435)t1415+24?m1s1
MFCD12030487
OC(=O)CCC(=O)Nc1ccc2c(c1)(nH)cc2C(N1C(C@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)C(=O)O
ZINC000100792491
ZINC000100792493
Check stock
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Check stock on Vitas-MAvailable files
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