Vitas-M small molecule compound
trans-4-[({2-[(6-chloro-2-oxo-4-phenyl-2H-chromen-7-yl)oxy]propanoyl}amino)methyl]cyclohexanecarboxylic acid
Catalog ID
STL532019
SMILES CC(C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)O)Oc1cc2oc(=O)cc(c2cc1Cl)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 C26H26ClNO6 MW 483.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClNO6/c1-15(25(30)28-14-16-7-9-18(10-8-16)26(31)32)33-23-13-22-20(11-21(23)27)19(12-24(29)34-22)17-5-3-2-4-6-17/h2-6,11-13,15-16,18H,7-10,14H2,1H3,(H,28,30)(H,31,32)/t15?,16-,18-InChIKey
JVVQEBDBIRUGIE-CPONINCNSA-NSynonyms
(1r4r)4((2((6chloro2oxo4phenyl2Hchromen7yl)oxy)propanamido)methyl)cyclohexanecarboxylicacid
CC(C(=O)NC(C@@H)1CC(C@H)(CC1)C(=O)O)Oc1cc2oc(=O)cc(c2cc1Cl)c1ccccc1
InChI=1SC26H26ClNO6c115(25(30)2814167918(10816)26(31)32)3323132220(1121(23)27)19(1224(29)3422)175324617h261113151618H71014H21H3(H2830)(H3132)t15?1618
MFCD05675027
trans4(((2((6chloro2oxo4phenyl2Hchromen7yl)oxy)propanoyl)amino)methyl)cyclohexanecarboxylicacid
ZINC000252694379
ZINC000252694380
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