97271-97-1 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C14H29N5O5.
The molecular weight is 347.41 g/mol.
The IUPAC name is acetic acid;(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoic acid.
The InChI is InChI=1S/C12H25N5O3.C2H4O2/c1-7(2)6-9(11(19)20)17-10(18)8(13)4-3-5-16-12(14)15;1-2(3)4/h7-9H,3-6,13H2,1-2H3,(H,17,18)(H,19,20)(H4,14,15,16);1H3,(H,3,4)/t8-,9-;/m0./s1
The InChIKey is NETLCCJRXLZURZ-OZZZDHQUSA-N.
The Canonical SMILES is CC(C)CC(C(=O)O)NC(=O)C(CCCN=C(N)N)N.CC(=O)O.
The Isomeric SMILES is CC(C)C[C@@H](C(=O)O)NC(=O)[C@H](CCCN=C(N)N)N.CC(=O)O.
The hydrogen bond donor count is 6.
The hydrogen bond acceptor count is 7.
The rotatable bond count is 9.
Please kindly note that our products are for research use only.
Download