Vitas-M small molecule compound

tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl 4-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoate

Catalog ID
STK665011
SMILES O=C(C1CCCO1)Nc1ccc(cc1)C(=O)OCC12CC3CC(C2)CC(C1)C3

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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 C23H29NO4 MW 383.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29NO4/c25-21(20-2-1-7-27-20)24-19-5-3-18(4-6-19)22(26)28-14-23-11-15-8-16(12-23)10-17(9-15)13-23/h3-6,15-17,20H,1-2,7-14H2,(H,24,25)
InChIKey
JKODYKJGILYCON-UHFFFAOYSA-N
Synonyms

1ADAMANTYLMETHYL4(OXOLANE2CARBONYLAMINO)BENZOATE
ADAMANTANYLMETHYL4(OXOLAN2YLCARBONYLAMINO)BENZOATE
C1CC(OC1)C(=O)NC2=CC=C(C=C2)C(=O)OCC34CC5CC(C3)CC(C5)C4
InChI=1SC23H29NO4c2521(202172720)24195318(4619)22(26)2814231115816(1223)1017(915)1323h36151720H12714H2(H2425)
MFCD07658404
tricyclo(3311~37~)dec1ylmethyl4((tetrahydrofuran2ylcarbonyl)amino)benzoate
ZINC000004783858
ZINC000004783860

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.