Vitas-M small molecule compound
(2Z,5Z)-3-hydroxy-1-phenyl-5-(2'H-spiro[cyclohexane-1,3'-isoquinolin]-1'(4'H)-ylidene)pent-2-ene-1,4-dione
Catalog ID
STK675135
SMILES O=C(/C(=C/C(=O)c1ccccc1)/O)/C=C/1\NC2(CCCCC2)Cc2c1cccc2
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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 C25H25NO3 MW 387.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25NO3/c27-22(18-9-3-1-4-10-18)16-24(29)23(28)15-21-20-12-6-5-11-19(20)17-25(26-21)13-7-2-8-14-25/h1,3-6,9-12,15-16,26,29H,2,7-8,13-14,17H2/b21-15-,24-16-InChIKey
GRTQNZZQNTVPFU-DNIYECPYSA-NSynonyms
(2Z5Z)3hydroxy1phenyl5(2Hspiro(cyclohexane13isoquinolin)1(4H)ylidene)pent2ene14dione
MFCD00688371
O=C(C(=CC(=O)c1ccccc1)O)C=C1NC2(CCCCC2)Cc2c1cccc2
ZINC000100075388
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