100929-62-2 ((ALA2)-蛋氨酸脑啡肽乙酸酯,L-Methionine,L-tyrosyl-D-alanylglycyl-L-phenylalanyl-, monoacetate (salt) (9CI))

CAS号:
100929-62-2
中文名称:
(ALA2)-蛋氨酸脑啡肽乙酸酯
英文名称:
L-Methionine,L-tyrosyl-D-alanylglycyl-L-phenylalanyl-, monoacetate (salt) (9CI)
分子式:
C30H43N5O10S
分子量:
665.754926919937

(ALA2)-蛋氨酸脑啡肽乙酸酯(100929-62-2)名称与标识符

名称

中文别名:
(ALA2)-蛋氨酸脑啡肽乙酸酯;
英文别名:
L-Methionine,L-tyrosyl-D-alanylglycyl-L-phenylalanyl-, monoacetate (salt) (9CI);H-tyr-d-ala-gly-phe-met-oh;TYR-D-ALA-GLY-PHE-MET ACOH H2O;Tyr-D-ALa-Gly-Phe-Met;[D-ALA2,MET5]-********** ACOH H2O;(D-ala2)-methionine ********** acetate;(ALA2)-METHIONINE ********** ACETATE;(D-alanine2)methionine **********;TYR-D-ALA-GLY-PHE-MET ACOH H2O USP/EP/BP;

标识符

InChIKey:
YCRNJSBSFLXKBP-OBIJKIJRSA-N
Inchi:
1S/C28H37N5O7S.C2H4O2.H2O/c1-17(31-26(37)21(29)14-19-8-10-20(34)11-9-19)25(36)30-16-24(35)32-23(15-18-6-4-3-5-7-18)27(38)33-22(28(39)40)12-13-41-2;1-2(3)4;/h3-11,17,21-23,34H,12-16,29H2,1-2H3,(H,30,36)(H,31,37)(H,32,35)(H,33,38)(H,39,40);1H3,(H,3,4);1H2/t17-,21+,22+,23+;;/m1../s1
SMILES:
[C@@H](NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@H](C(=O)O)CCSC)CC1C=CC=CC=1.CC(=O)O.O

(ALA2)-蛋氨酸脑啡肽乙酸酯(100929-62-2)物化性质

实验特性

  • LogP : 2.22340
  • PSA : 271.78000

计算特性

  • 精确分子量 : 665.27300