Vitas-M small molecule compound

trans-4-[({[(3-benzyl-6-chloro-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}amino)methyl]cyclohexanecarboxylic acid

Catalog ID
STL516462
SMILES O=C(COc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1)NC[C@@H]1CC[C@H](CC1)C(=O)O

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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 C27H28ClNO6 MW 497.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClNO6/c1-16-20-12-22(28)24(13-23(20)35-27(33)21(16)11-17-5-3-2-4-6-17)34-15-25(30)29-14-18-7-9-19(10-8-18)26(31)32/h2-6,12-13,18-19H,7-11,14-15H2,1H3,(H,29,30)(H,31,32)/t18-,19-
InChIKey
HONJASKKANWMMO-WGSAOQKQSA-N
Synonyms

(1r4r)4((2((3benzyl6chloro4methyl2oxo2Hchromen7yl)oxy)acetamido)methyl)cyclohexanecarboxylicacid
InChI=1SC27H28ClNO6c116201222(28)24(1323(20)3527(33)21(16)11175324617)341525(30)2914187919(10818)26(31)32h2612131819H7111415H21H3(H2930)(H3132)t1819
MFCD05674139
O=C(COc1cc2oc(=O)c(c(c2cc1Cl)C)Cc1ccccc1)NC(C@@H)1CC(C@H)(CC1)C(=O)O
trans4(((((3benzyl6chloro4methyl2oxo2Hchromen7yl)oxy)acetyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000252694046

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Available files

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