Vitas-M small molecule compound
3-(3-ethoxy-3-oxopropyl)-4-methyl-2-oxo-2H-chromen-7-yl 4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexanecarboxylate
Catalog ID
STL517020
SMILES CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OC(=O)C1CCC(CC1)CNC(=O)OCc1ccccc1
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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 C31H35NO8 MW 549.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35NO8/c1-3-37-28(33)16-15-26-20(2)25-14-13-24(17-27(25)40-30(26)35)39-29(34)23-11-9-21(10-12-23)18-32-31(36)38-19-22-7-5-4-6-8-22/h4-8,13-14,17,21,23H,3,9-12,15-16,18-19H2,1-2H3,(H,32,36)InChIKey
USWXDZCHSPCPJX-UHFFFAOYSA-NSynonyms
1212241-28-5(1r4r)3(3ethoxy3oxopropyl)4methyl2oxo2Hchromen7yl4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
(3(3ETHOXY3OXOPROPYL)4METHYL2OXOCHROMEN7YL)4(PHENYLMETHOXYCARBONYLAMINOMETHYL)CYCLOHEXANE1CARBOXYLATE
1212241285
3(3ethoxy3oxopropyl)4methyl2oxo2Hchromen7yl4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
3764773
CCOC(=O)CCc1c(=O)oc2c(c1C)ccc(c2)OC(=O)(C@@H)1CC(C@H)(CC1)CNC(=O)OCc1ccccc1
InChI=1SC31H35NO8c133728(33)16152620(2)25141324(1727(25)4030(26)35)3929(34)2311921(101223)183231(36)3819227546822h481314172123H391215161819H212H3(H3236)
MFCD31752116
ZINC000070691802
ZINC253387689
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