Ctp-srih

10-(4-aminobutyl)-N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-19-[(2-amino-3-phenylpropanoyl)amino]-7-(1-hydroxyethyl)-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-2-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide

Also Known As: Ctp-srih|Ctp-NH2|Phe-cycl(cys-tyr-trp-lys-thr-pen)thr-NH2|Phenylalanyl-cyclo(cysteinyl-tyrosyltryptophyl-lysyl-threonyl-penicillamine)threoninamide|10-(4-aminobutyl)-n-(1-amino-3-hydroxy-1-oxobutan-2-yl)-16-(4-hydroxybenzyl)-7-(1-hydroxyethyl)-13-(1h-indol-2-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-19-(phenylalanylamino)-1,2-dithia-5,8,11,14,17-pentaazacycloicosane-4-carboxamide|10-(4-aminobutyl)-N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-19-[(2-amino-3-phenylpropanoyl)amino]-7-(1-hydroxyethyl)-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-2-ylmethyl)-3,3-dimethyl-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide|L-Threoninamide, D-phenylalanyl-L-cysteinyl-L-tyrosyl-D-tryptophyl-L-lysyl-L-(2-7)-disulfide

Molecular Formula	C51H69N11O11S2
Molecular Weight	1075.4619 g/mol
LogP	0.9
Topological Polar Surface Area	426.0 Ų
Hydrogen Bond Donors	14
Hydrogen Bond Acceptors	15
Rotatable Bonds	17
Exact Mass	1075.4619
Monoisotopic Mass	1075.4619
Heavy Atoms	75
Complexity	1940.0

Chemical Identifiers

CAS Number	2510-01-2
SMILES	CC(C1C(=O)NC(C(SSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)CCCCN)CC2=CC3=CC=CC=C3N2)CC4=CC=C(C=C4)O)NC(=O)C(CC5=CC=CC=C5)N)(C)C)C(=O)NC(C(C)O)C(=O)N)O
InChIKey	MOBFVGBRZZZQHB-UHFFFAOYSA-N