Glutamyl-asparaginyl-prolyl-seryl-glutaminyl-phenylalanyl-tyrosyl-glutamyl-arginyl-leucyl-cysteinamide

The molecular formula is C60H89N17O19S.

It was first created on December 10, 2008.

The molecular weight is 1384.5 g/mol.

The IUPAC name is (4S)-4-amino-5-[[(2S)-4-amino-1-[(2S)-2-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-amino-1-oxo-3-sulfanylpropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]carbamoyl]pyrrolidin-1-yl]-1,4-dioxobutan-2-yl]amino]-5-oxopentanoic acid.

The InChI key is FWNLUXRCGOYZBI-UZNCLCIMSA-N.

The Canonical SMILES representation is CC(C)CC(C(=O)NC(CS)C(=O)N)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCC(=O)O)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CCC(=O)N)NC(=O)C(CO)NC(=O)C3CCCN3C(=O)C(CC(=O)N)NC(=O)C(CCC(=O)O)N.

It has 20 hydrogen bond donor counts.

The XLogP3-AA value is -7.8.

It was last modified on December 30, 2023.

The topological polar surface area is 618 Ų.