Vitas-M small molecule compound
5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl trans-4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexanecarboxylate
Catalog ID
STL553381
SMILES O=C(OCc1ccccc1)NC[C@@H]1CCC(CC1)C(=O)Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1
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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 C31H29NO7 MW 527.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO7/c33-25-15-24(16-28-29(25)26(34)17-27(39-28)22-9-5-2-6-10-22)38-30(35)23-13-11-20(12-14-23)18-32-31(36)37-19-21-7-3-1-4-8-21/h1-10,15-17,20,23,33H,11-14,18-19H2,(H,32,36)/t20-,23?InChIKey
JSVVVFVSTMDBEL-FDBFYXBASA-NSynonyms
(1r4r)5hydroxy4oxo2phenyl4Hchromen7yl4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
5hydroxy4oxo2phenyl4Hchromen7yltrans4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
InChI=1SC31H29NO7c33251524(162829(25)26(34)1727(3928)2295261022)3830(35)23131120(121423)183231(36)3719217314821h1101517202333H11141819H2(H3236)t2023?
O=C(OCc1ccccc1)NC(C@@H)1CCC(CC1)C(=O)Oc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1
ZINC000012871961
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