Vitas-M small molecule compound

(1R,2S,1'R,2'S)-2,2'-(ethane-1,2-diyldicarbamoyl)dicyclohexanecarboxylic acid

Catalog ID
STK026073
SMILES O=C([C@H]1CCCC[C@H]1C(=O)O)NCCNC(=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 C18H28N2O6 MW 368.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N2O6/c21-15(11-5-1-3-7-13(11)17(23)24)19-9-10-20-16(22)12-6-2-4-8-14(12)18(25)26/h11-14H,1-10H2,(H,19,21)(H,20,22)(H,23,24)(H,25,26)/t11-,12-,13+,14+/m0/s1
InChIKey
YXNBHSFRFDRSLQ-IGQOVBAYSA-N
Synonyms

(1R2S)2(2(((1S2R)2carboxycyclohexanecarbonyl)amino)ethylcarbamoyl)cyclohexane1carboxylicacid
(1R2S1R2S)22(ETHANE12DIYLDICARBAMOYL)DICYCLOHEXANECARBOXYLICACID
C1CCC(C(C1)C(=O)NCCNC(=O)C2CCCCC2C(=O)O)C(=O)O
InChI=1SC18H28N2O6c2115(11513713(11)17(23)24)199102016(22)12624814(12)18(25)26h1114H110H2(H1921)(H2022)(H2324)(H2526)t111213+14+m0s1
MFCD03544639
O=C((C@H)1CCCC(C@H)1C(=O)O)NCCNC(=O)(C@H)1CCCC(C@H)1C(=O)O
STK026073
ZINC000004592346
ZINC4592346

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Available files

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