Vitas-M small molecule compound
N-{7-[hydroxy(phenyl)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}tricyclo[3.3.1.1~3,7~]decane-1-carboxamide
Catalog ID
STK689306
SMILES O=C(C12CC3CC(C2)CC(C1)C3)Nc1cc2OCCOc2cc1C(c1ccccc1)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 C26H29NO4 MW 419.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29NO4/c28-24(19-4-2-1-3-5-19)20-11-22-23(31-7-6-30-22)12-21(20)27-25(29)26-13-16-8-17(14-26)10-18(9-16)15-26/h1-5,11-12,16-18,24,28H,6-10,13-15H2,(H,27,29)InChIKey
GBDRMTHKFLQUBB-UHFFFAOYSA-NSynonyms
C1COC2=C(O1)C=C(C(=C2)NC(=O)C34CC5CC(C3)CC(C5)C4)C(C6=CC=CC=C6)O
InChI=1SC26H29NO4c2824(194213519)20112223(31763022)1221(20)2725(29)261316817(1426)1018(916)1526h15111216182428H6101315H2(H2729)
N(7(HYDROXY(PHENYL)METHYL)23DIHYDRO14BENZODIOXIN6YL)ADAMANTANE1CARBOXAMIDE
N(7(hydroxy(phenyl)methyl)23dihydro14benzodioxin6yl)tricyclo(3311~37~)decane1carboxamide
ZINC000006668098
ZINC000006668099
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