Vitas-M small molecule compound
(1S,2R,1'S,2'R)-2,2'-(hexane-1,6-diyldicarbamoyl)dicyclohexanecarboxylic acid
Catalog ID
STK078497
SMILES O=C([C@@H]1CCCC[C@@H]1C(=O)O)NCCCCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=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 C22H36N2O6 MW 424.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H36N2O6/c25-19(15-9-3-5-11-17(15)21(27)28)23-13-7-1-2-8-14-24-20(26)16-10-4-6-12-18(16)22(29)30/h15-18H,1-14H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)/t15-,16-,17+,18+/m1/s1InChIKey
LCZDXNPZDNPEER-BDXSIMOUSA-NSynonyms
(1S2R)2(6(((1R2S)2carboxycyclohexanecarbonyl)amino)hexylcarbamoyl)cyclohexane1carboxylicacid
(1S2R1S2R)22(HEXANE16DIYLDICARBAMOYL)DICYCLOHEXANECARBOXYLICACID
C1CCC(C(C1)C(=O)NCCCCCCNC(=O)C2CCCCC2C(=O)O)C(=O)O
InChI=1SC22H36N2O6c2519(159351117(15)21(27)28)23137128142420(26)1610461218(16)22(29)30h1518H114H2(H2325)(H2426)(H2728)(H2930)t151617+18+m1s1
MFCD03373196
O=C((C@@H)1CCCC(C@@H)1C(=O)O)NCCCCCCNC(=O)(C@@H)1CCCC(C@@H)1C(=O)O
STK078497
ZINC000004657019
ZINC4657019
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