Vitas-M small molecule compound
ethyl 4-(N-{[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)phenyl]carbonyl}valyl)piperazine-1-carboxylate
Catalog ID
STL417940
SMILES CCOC(=O)N1CCN(CC1)C(=O)C(C(C)C)NC(=O)c1ccc(cc1)C12CC3CC(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 C29H41N3O4 MW 495.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H41N3O4/c1-4-36-28(35)32-11-9-31(10-12-32)27(34)25(19(2)3)30-26(33)23-5-7-24(8-6-23)29-16-20-13-21(17-29)15-22(14-20)18-29/h5-8,19-22,25H,4,9-18H2,1-3H3,(H,30,33)InChIKey
HAXDCNPWGZTLDP-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)C(=O)C(C(C)C)NC(=O)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4
ETHYL4(2((4(1ADAMANTYL)BENZOYL)AMINO)3METHYLBUTANOYL)PIPERAZINE1CARBOXYLATE
ethyl4(N((4(tricyclo(3311~37~)dec1yl)phenyl)carbonyl)valyl)piperazine1carboxylate
InChI=1SC29H41N3O4c143628(35)3211931(101232)27(34)25(19(2)3)3026(33)235724(8623)2916201321(1729)1522(1420)1829h58192225H4918H213H3(H3033)
ZINC000020116194
ZINC000020116196
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