Vitas-M small molecule compound
4-[({N-[(4-hydroxyphthalazin-1-yl)acetyl]alanyl}amino)methyl]cyclohexanecarboxylic acid
Catalog ID
STK630921
SMILES O=C(Cc1nnc(c2c1cccc2)O)NC(C(=O)NCC1CCC(CC1)C(=O)O)C
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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 C21H26N4O5 MW 414.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O5/c1-12(19(27)22-11-13-6-8-14(9-7-13)21(29)30)23-18(26)10-17-15-4-2-3-5-16(15)20(28)25-24-17/h2-5,12-14H,6-11H2,1H3,(H,22,27)(H,23,26)(H,25,28)(H,29,30)InChIKey
DPIXFLIAABXORK-UHFFFAOYSA-NSynonyms
4(((N((4hydroxyphthalazin1yl)acetyl)alanyl)amino)methyl)cyclohexanecarboxylicacid
4((2((2(4oxo3Hphthalazin1yl)acetyl)amino)propanoylamino)methyl)cyclohexane1carboxylicacid
CC(C(=O)NCC1CCC(CC1)C(=O)O)NC(=O)CC2=NNC(=O)C3=CC=CC=C32
InChI=1SC21H26N4O5c112(19(27)2211136814(9713)21(29)30)2318(26)101715423516(15)20(28)252417h251214H611H21H3(H2227)(H2326)(H2528)(H2930)
MFCD09791239
ZINC000009304333
ZINC000013553014
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