Vitas-M small molecule compound
3-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}-7-(propan-2-ylidene)bicyclo[2.2.1]heptane-2-carboxylic acid
Catalog ID
STK423544
SMILES O=C(C1C2CCC(C1C(=O)O)C2=C(C)C)NCCC1=CCCCC1
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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 C20H29NO3 MW 331.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29NO3/c1-12(2)16-14-8-9-15(16)18(20(23)24)17(14)19(22)21-11-10-13-6-4-3-5-7-13/h6,14-15,17-18H,3-5,7-11H2,1-2H3,(H,21,22)(H,23,24)InChIKey
ZTUAJOYALITIFU-UHFFFAOYSA-NSynonyms
2(2(CYCLOHEXEN1YL)ETHYLCARBAMOYL)7PROPAN2YLIDENEBICYCLO(221)HEPTANE3CARBOXYLICACID
3((2(cyclohex1en1yl)ethyl)carbamoyl)7(propan2ylidene)bicyclo(221)heptane2carboxylicacid
3(N(2CYCLOHEX1ENYLETHYL)CARBAMOYL)7(METHYLETHYLIDENE)BICYCLO(221)HEPTANE2CARBOXYLICACID
CC(=C1C2CCC1C(C2C(=O)NCCC3=CCCCC3)C(=O)O)C
InChI=1SC20H29NO3c112(2)16148915(16)18(20(23)24)17(14)19(22)211110136435713h614151718H35711H212H3(H2122)(H2324)
MFCD01923388
ZINC000100866092
ZINC000229850181
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