Vitas-M small molecule compound
3-[(2-phenylethyl)carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Catalog ID
STK458481
SMILES O=C(C1C2C=CC(C1C(=O)O)O2)NCCc1ccccc1
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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 C16H17NO4 MW 287.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO4/c18-15(17-9-8-10-4-2-1-3-5-10)13-11-6-7-12(21-11)14(13)16(19)20/h1-7,11-14H,8-9H2,(H,17,18)(H,19,20)InChIKey
HAUYFFDGFFLJSE-UHFFFAOYSA-NSynonyms
2(2phenylethylcarbamoyl)7oxabicyclo(221)hept5ene3carboxylicacid
2(PHENETHYLCARBAMOYL)7OXABICYCLO(221)HEPT5ENE3CARBOXYLICACID
3((2phenylethyl)carbamoyl)7oxabicyclo(221)hept5ene2carboxylicacid
3(N(2PHENYLETHYL)CARBAMOYL)7OXABICYCLO(221)HEPT5ENE2CARBOXYLICACID
C1=CC=C(C=C1)CCNC(=O)C2C3C=CC(C2C(=O)O)O3
InChI=1SC16H17NO4c1815(1798104213510)13116712(2111)14(13)16(19)20h171114H89H2(H1718)(H1920)
MFCD01357780
ZINC000225723807
ZINC000239308865
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