1020407-90-2 ((Chemerin15)

CAS号:
1020407-90-2
英文名称:
Chemerin15
分子式:
C75H100N18O22
分子量:
1605.70391750336

Chemerin15(1020407-90-2)名称与标识符

名称

英文别名:
Chemerin15;L-Alanine, L-alanylglycyl-L-α-glutamyl-L-α-aspartyl-L-prolyl-L-histidylglycyl-L-tyrosyl-L-phenylalanyl-L-leucyl-L-prolylglycyl-L-glutaminyl-L-phenylalanyl-;

标识符

InChIKey:
QTFBQQVMWXNUGD-HRKVGLAYSA-N
Inchi:
1S/C75H100N18O22/c1-40(2)29-54(73(112)92-27-11-17-56(92)71(110)81-38-60(97)84-48(23-25-58(77)95)66(105)87-51(30-43-13-7-5-8-14-43)68(107)83-42(4)75(114)115)90-70(109)52(31-44-15-9-6-10-16-44)88-69(108)50(32-45-19-21-47(94)22-20-45)86-61(98)37-80-65(104)53(33-46-35-78-39-82-46)89-72(111)57-18-12-28-93(57)74(113)55(34-63(101)102)91-67(106)49(24-26-62(99)100)85-59(96)36-79-64(103)41(3)76/h5-10,13-16,19-22,35,39-42,48-57,94H,11-12,17-18,23-34,36-38,76H2,1-4H3,(H2,77,95)(H,78,82)(H,79,103)(H,80,104)(H,81,110)(H,83,107)(H,84,97)(H,85,96)(H,86,98)(H,87,105)(H,88,108)(H,89,111)(H,90,109)(H,91,106)(H,99,100)(H,101,102)(H,114,115)/t41-,42-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-/m0/s1
SMILES:
C([C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@@H](N)C)(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)O)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)CC1C=CC(=CC=1)O)CC1NC=NC=1

Chemerin15(1020407-90-2)物化性质

实验特性

  • 沸点 : 2043.721±65.00 °C(Press: 760.00 Torr)(predicted)
  • 密度 : 1.378±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)