RX 783030

(2S)-3-[4-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]phenyl]-N-[2-[[(2R)-2-aminopropanoyl]amino]acetyl]-2-[2-[hydroxy(methyl)amino]propyl-methylamino]propanamide

Also Known As: RX 783030|Enkephalin, ala(2)-N-(2-(dimethylamino)ethyl)-N(alpha)-methyl-N-oxy-phenh2(4)-|(2S)-3-[4-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]phenyl]-N-[2-[[(2R)-2-aminopropanoyl]amino]acetyl]-2-[2-[hydroxy(methyl)amino]propyl-methylamino]propanamide|2-Ala-N-(2-(dimethylamino)ethyl)-N-(alpha)-Me-N-oxy-4-phenh2-enkephalin|Enkephalin, alanyl (2)-N-(2-(dimethylamino)ethyl)-N(alpha)-methyl-N-oxy-phenylalaninamide(4)-|(2R)-2-Amino-N-{2-[(4-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-N-{2-[hydroxy(methyl)amino]propyl}-N-methyl-L-phenylalanyl)imino]-2-hydroxyethyl}propanimidic acid|2-Amino-N-{2-[(4-[2-amino-3-(4-hydroxyphenyl)propanoyl]-N-{2-[hydroxy(methyl)amino]propyl}-N-methylphenylalanyl)imino]-2-hydroxyethyl}propanimidic acid|L-Phenylalaninamide, L-tyrosyl-D-alanylglycyl-N-(2-(dimethylamino)ethyl)-N(alpha)-methyl-, N-oxide

Molecular Formula	C28H40N6O6
Molecular Weight	556.3009 g/mol
LogP	0.6
Topological Polar Surface Area	191.0 Ų
Hydrogen Bond Donors	6
Hydrogen Bond Acceptors	10
Rotatable Bonds	14
Exact Mass	556.3009
Monoisotopic Mass	556.3009
Heavy Atoms	40
Complexity	843.0

Chemical Identifiers

CAS Number	72080-55-8
SMILES	C[C@H](C(=O)NCC(=O)NC(=O)[C@H](CC1=CC=C(C=C1)C(=O)[C@H](CC2=CC=C(C=C2)O)N)N(C)CC(C)N(C)O)N
InChIKey	OYMHSGJPTUBJMN-FZOCWHRGSA-N