Vitas-M small molecule compound

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

Catalog ID
STK717551
SMILES O=C(OCc1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)C

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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 C26H26ClNO6 MW 483.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO6/c1-16-11-24(29)33-22-13-23(21(27)12-20(16)22)34-25(30)19-9-7-17(8-10-19)14-28-26(31)32-15-18-5-3-2-4-6-18/h2-6,11-13,17,19H,7-10,14-15H2,1H3,(H,28,31)/t17-,19-
InChIKey
LKPMTLBVBGOGOX-UAPYVXQJSA-N
Synonyms

(1r4r)6chloro4methyl2oxo2Hchromen7yl4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
6chloro4methyl2oxo2Hchromen7yltrans4((((benzyloxy)carbonyl)amino)methyl)cyclohexanecarboxylate
MFCD05689800
O=C(OCc1ccccc1)NC(C@@H)1CC(C@H)(CC1)C(=O)Oc1cc2oc(=O)cc(c2cc1Cl)C
ZINC000238901325

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.