Vitas-M small molecule compound
N~5~-carbamoyl-N~2~-({4-[(1-hydroxycyclohexyl)ethynyl]phenyl}carbonyl)ornithine
Catalog ID
STK185393
SMILES O=C(c1ccc(cc1)C#CC1(O)CCCCC1)NC(C(=O)O)CCCNC(=O)N
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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 C21H27N3O5 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3O5/c22-20(28)23-14-4-5-17(19(26)27)24-18(25)16-8-6-15(7-9-16)10-13-21(29)11-2-1-3-12-21/h6-9,17,29H,1-5,11-12,14H2,(H,24,25)(H,26,27)(H3,22,23,28)InChIKey
AGBIWZMFBISIKO-UHFFFAOYSA-NSynonyms
5(CARBAMOYLAMINO)2((4(2(1HYDROXYCYCLOHEXYL)ETHYNYL)BENZOYL)AMINO)PENTANOICACID
C1CCC(CC1)(C#CC2=CC=C(C=C2)C(=O)NC(CCCNC(=O)N)C(=O)O)O
InChI=1SC21H27N3O5c2220(28)23144517(19(26)27)2418(25)168615(7916)101321(29)112131221h691729H15111214H2(H2425)(H2627)(H3222328)
MFCD05854310
N~5~carbamoylN~2~((4((1hydroxycyclohexyl)ethynyl)phenyl)carbonyl)ornithine
N5(AMINOCARBONYL)N2(4((1HYDROXYCYCLOHEXYL)ETHYNYL)BENZOYL)ORNITHINE
N5CARBAMOYLN2((4((1HYDROXYCYCLOHEXYL)ETHYNYL)PHENYL)CARBONYL)ORNITHINE
N5CARBAMOYLN2(4((1HYDROXYCYCLOHEXYL)ETHYNYL)BENZOYL)LORNITHINE
ZINC000002867346
ZINC000002867347
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