beta-Endorphin (1-9)

(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]hexanoic acid

Also Known As: beta-Endorphin 1-9|beta-Endorphin (1-9)||A-Lipotropin (61-69)|Boc-Tyr-Gly-Gly-Phe-Met-OH|HY-P3515|Tyr-Gly-Gly-Phe-Met-Thr-Ser-Glu-Lys|alpha-Endorphin, 10-de-L-serine-11-de-L-glutamine-12-de-L-threonine-13-de-L-proline-14-de-L-leucine-15-de-L-valine-16-de-L-threonine-|alpha-Endorphin, 10-de-L-serine-11-de-L-glutamine-12-de-L-threonine-13 -de-L-proline-14-de-L-leucine-15-de-L-valine-16-de-L-threonine-|(2S)-6-AMINO-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-(2-{2-[(2S)-2-AMINO-3-(4-HYDROXYPHENYL)PROPANAMIDO]ACETAMIDO}ACETAMIDO)-3-PHENYLPROPANAMIDO]-4-(METHYLSULFANYL)BUTANAMIDO]-3-HYDROXYBUTANAMIDO]-3-HYDROXYPROPANAMIDO]-4-CARBOXYBUTANAMIDO]HEXANOIC ACID|(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]hexanoic acid|(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxybutanoyl]amino]-3-hydroxypropanoyl]amino]-5-hydroxy-5-oxopentanoyl]amino]hexanoic acid|L-Tyrosylglycylglycyl-L-phenylalanyl-L-methionyl-L-threonyl-L-seryl-L-alpha-glutamyl-L-lysine

Molecular Formula	C45H66N10O15S
Molecular Weight	1018.443 g/mol
LogP	-4.1495
Topological Polar Surface Area	420.13 Ų
Hydrogen Bond Donors	15
Hydrogen Bond Acceptors	16
Rotatable Bonds	33
Exact Mass	1018.443
Monoisotopic Mass	1018.443
Heavy Atoms	71
Complexity	2101.755

Chemical Identifiers

CAS Number	59481-79-7
SMILES	C[C@H]([C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCSC)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](CC2=CC=C(C=C2)O)N)O