Vitas-M small molecule compound
4-({[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]amino}methyl)cyclohexanecarboxylic acid
Catalog ID
STL510987
SMILES O=C(CCc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)NCC1CCC(CC1)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 C21H24ClNO6 MW 421.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClNO6/c1-11-14(21(28)29-18-9-17(24)16(22)8-15(11)18)6-7-19(25)23-10-12-2-4-13(5-3-12)20(26)27/h8-9,12-13,24H,2-7,10H2,1H3,(H,23,25)(H,26,27)InChIKey
HZVGPXGUCCXZIQ-UHFFFAOYSA-NSynonyms
1173678-46-0(1s4s)4((3(6chloro7hydroxy4methyl2oxo2Hchromen3yl)propanamido)methyl)cyclohexanecarboxylicacid
1173678460
4(((3(6chloro7hydroxy4methyl2oxo2Hchromen3yl)propanoyl)amino)methyl)cyclohexanecarboxylicacid
4((3(6CHLORO7HYDROXY4METHYL2OXOCHROMEN3YL)PROPANOYLAMINO)METHYL)CYCLOHEXANE1CARBOXYLICACID
5935567
InChI=1SC21H24ClNO6c11114(21(28)2918917(24)16(22)815(11)18)6719(25)2310122413(5312)20(26)27h89121324H2710H21H3(H2325)(H2627)
MFCD31750873
O=C(CCc1c(=O)oc2c(c1C)cc(c(c2)O)Cl)NCC1CC(C@H)(CC1)C(=O)O
ZINC000002114030
ZINC217465686
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