Vitas-M small molecule compound
3-benzyl-4,7-dimethyl-2-oxo-2H-chromen-5-yl 4-{[(tert-butoxycarbonyl)amino]methyl}cyclohexanecarboxylate
Catalog ID
STL515124
SMILES O=C(OC(C)(C)C)NCC1CCC(CC1)C(=O)Oc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1
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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 C31H37NO6 MW 519.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H37NO6/c1-19-15-25(27-20(2)24(29(34)37-26(27)16-19)17-21-9-7-6-8-10-21)36-28(33)23-13-11-22(12-14-23)18-32-30(35)38-31(3,4)5/h6-10,15-16,22-23H,11-14,17-18H2,1-5H3,(H,32,35)InChIKey
YBOJKLFXBIRWJC-UHFFFAOYSA-NSynonyms
1212092-47-1(1r4r)3benzyl47dimethyl2oxo2Hchromen5yl4(((tertbutoxycarbonyl)amino)methyl)cyclohexanecarboxylate
(3BENZYL47DIMETHYL2OXOCHROMEN5YL)4(((2METHYLPROPAN2YL)OXYCARBONYLAMINO)METHYL)CYCLOHEXANE1CARBOXYLATE
1212092471
1775577
3benzyl47dimethyl2oxo2Hchromen5yl4(((tertbutoxycarbonyl)amino)methyl)cyclohexanecarboxylate
InChI=1SC31H37NO6c1191525(2720(2)24(29(34)3726(27)1619)172197681021)3628(33)23131122(121423)183230(35)3831(34)5h61015162223H11141718H215H3(H3235)
MFCD31752096
O=C(OC(C)(C)C)NC(C@@H)1CC(C@H)(CC1)C(=O)Oc1cc(C)cc2c1c(C)c(c(=O)o2)Cc1ccccc1
ZINC000002120619
ZINC252695313
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