Vitas-M small molecule compound
2-methylpropyl (3aR,8bR)-10-amino-11-cyano-2-methyl-4-oxo-4H-8b,3a-(epoxyetheno)indeno[1,2-b]furan-3-carboxylate
Catalog ID
STK363820
SMILES N#CC1=C(N)O[C@]23[C@]1(C(=C(O2)C)C(=O)OCC(C)C)C(=O)c1c3cccc1
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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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-10(2)9-25-18(24)15-11(3)26-20-13-7-5-4-6-12(13)16(23)19(15,20)14(8-21)17(22)27-20/h4-7,10H,9,22H2,1-3H3/t19-,20-/m1/s1InChIKey
BYHDZUGZPZTKLS-WOJBJXKFSA-NSynonyms
295313-63-211ISOBUTOXYCARBONYL10METHYL2AMINO4OXO43A8BTRIHYDRO3A8BEXPOXYETHENOINDENO(12B)FURAN3CARBONITRILE
295313632
2METHYLPROPYL(3AR8BR)10AMINO11CYANO2METHYL4OXO4H8B3A(EPOXYETHENO)INDENO(12B)FURAN3CARBOXYLATE
CC1=C(C23C(=C(OC2(O1)C4=CC=CC=C4C3=O)N)C#N)C(=O)OCC(C)C
InChI=1SC20H18N2O5c110(2)92518(24)1511(3)262013754612(13)16(23)19(1520)14(821)17(22)2720h4710H922H213H3t1920m1s1
MFCD13368833
N#CC1=C(N)O(C@)23(C@)1(C(=C(O2)C)C(=O)OCC(C)C)C(=O)c1c3cccc1
ZINC000000685711
ZINC00685711
ZINC685711
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