Vitas-M small molecule compound
2-oxo-2H-chromen-7-yl trans-4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Catalog ID
STL515564
SMILES O=C(OC(C)(C)C)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc2c(c1)oc(=O)cc2
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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 C22H27NO6 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO6/c1-22(2,3)29-21(26)23-13-14-4-6-16(7-5-14)20(25)27-17-10-8-15-9-11-19(24)28-18(15)12-17/h8-12,14,16H,4-7,13H2,1-3H3,(H,23,26)/t14-,16-InChIKey
ZFXKQDXNMAHVQI-KOMQPUFPSA-NSynonyms
(1r4r)2oxo2Hchromen7yl4(((tertbutoxycarbonyl)amino)methyl)cyclohexanecarboxylate
2oxo2Hchromen7yltrans4(((tertbutoxycarbonyl)amino)methyl)cyclohexanecarboxylate
InChI=1SC22H27NO6c122(23)2921(26)2313144616(7514)20(25)27171081591119(24)2818(15)1217h8121416H4713H213H3(H2326)t1416
MFCD05676475
O=C(OC(C)(C)C)NC(C@@H)1CC(C@H)(CC1)C(=O)Oc1ccc2c(c1)oc(=O)cc2
ZINC000252695386
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