Vitas-M small molecule compound
(2S)-{[3-(7,8-dimethoxy-4-methyl-2-oxo-2H-chromen-3-yl)propanoyl]amino}(phenyl)ethanoic acid
Catalog ID
STL465063
SMILES COc1c(OC)ccc2c1oc(=O)c(c2C)CCC(=O)N[C@@H](c1ccccc1)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 C23H23NO7 MW 425.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO7/c1-13-15-9-11-17(29-2)21(30-3)20(15)31-23(28)16(13)10-12-18(25)24-19(22(26)27)14-7-5-4-6-8-14/h4-9,11,19H,10,12H2,1-3H3,(H,24,25)(H,26,27)/t19-/m0/s1InChIKey
AERCIJASRHZSIZ-IBGZPJMESA-NSynonyms
(2S)((3(78dimethoxy4methyl2oxo2Hchromen3yl)propanoyl)amino)(phenyl)ethanoicacid
(2S)2(3(78dimethoxy4methyl2oxochromen3yl)propanoylamino)2phenylaceticacid
(R)2(3(78dimethoxy4methyl2oxo2Hchromen3yl)propanamido)2phenylaceticacid
CC1=C(C(=O)OC2=C1C=CC(=C2OC)OC)CCC(=O)NC(C3=CC=CC=C3)C(=O)O
COc1c(OC)ccc2c1oc(=O)c(c2C)CCC(=O)N(C@@H)(c1ccccc1)C(=O)O
COc1c(OC)ccc2c1oc(=O)c(c2C)CCC(=O)N(C@H)(c1ccccc1)C(=O)O
InChI=1SC23H23NO7c1131591117(292)21(303)20(15)3123(28)16(13)101218(25)2419(22(26)27)147546814h491119H1012H213H3(H2425)(H2627)t19m0s1
ZINC000020426565
ZINC20426565
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