Vitas-M small molecule compound

3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl trans-4-({[(benzyloxy)carbonyl]amino}methyl)cyclohexanecarboxylate

Catalog ID
STL461766
SMILES O=C(OCc1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)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 C33H33NO6 MW 539.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H33NO6/c1-22-28-17-16-27(19-30(28)40-32(36)29(22)18-23-8-4-2-5-9-23)39-31(35)26-14-12-24(13-15-26)20-34-33(37)38-21-25-10-6-3-7-11-25/h2-11,16-17,19,24,26H,12-15,18,20-21H2,1H3,(H,34,37)/t24-,26-
InChIKey
LPOGWNVBPXXIBC-YOCNBXQISA-N
Synonyms

(1r4r)3benzyl4methyl2oxo2Hchromen7yl4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
3benzyl4methyl2oxo2Hchromen7yltrans4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
MFCD10041066
O=C(OCc1ccccc1)NC(C@@H)1CC(C@H)(CC1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1
O=C(OCc1ccccc1)NC(C@@H)1CCC(CC1)C(=O)Oc1ccc2c(c1)oc(=O)c(c2C)Cc1ccccc1
ZINC000238901360

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Available files

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