Vitas-M small molecule compound
6-(2-hydroxybut-3-yn-2-yl)-3a,4,5,6,7,7a-hexahydro-4,7-methano-1,2-benzoxazole-3-carboxamide
Catalog ID
STK691672
SMILES C#CC(C1CC2CC1C1C2C(=NO1)C(=O)N)(O)C
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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 C13H16N2O3 MW 248.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O3/c1-3-13(2,17)8-5-6-4-7(8)11-9(6)10(12(14)16)15-18-11/h1,6-9,11,17H,4-5H2,2H3,(H2,14,16)InChIKey
BBQJOVNBTRBPSE-UHFFFAOYSA-NSynonyms
6(2hydroxybut3yn2yl)3a45677ahexahydro47methano12benzoxazole3carboxamide
CC(C#C)(C1CC2CC1C3C2C(=NO3)C(=O)N)O
InChI=1SC13H16N2O3c1313(217)85647(8)119(6)10(12(14)16)151811h1691117H45H22H3(H21416)
MFCD10037774
ZINC000245254614
ZINC000245254617
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