PRO-VAL-PRO-LEU-GLN-LEU-PRO-PRO-LEU-GLU-ARG-LEU-THR-LEU-ASP

CAS No.
CCD No.
CCD00118446
Formula
C79 H133 N19 O22
MolWeight
1701.03

Basic Information

Product Name: PRO-VAL-PRO-LEU-GLN-LEU-PRO-PRO-LEU-GLU-ARG-LEU-THR-LEU-ASP
English Synonyms: PRO-VAL-PRO-LEU-GLN-LEU-PRO-PRO-LEU-GLU-ARG-LEU-THR-LEU-ASP ; REV (70-84)
MDL Number.: MFCD00273745
H bond acceptor: 41
H bond donor: 20
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]3CCCN3C(=O)[C@H](C(C)C)NC(=O)[C@@H]4CCCN4
InChi: InChI=1S/C79H133N19O22/c1-39(2)33-50(90-73(114)57-22-17-31-97(57)77(118)62(44(11)12)94-64(105)46-19-14-28-83-46)68(109)86-48(24-26-59(80)100)67(108)92-54(37-43(9)10)75(116)98-32-18-23-58(98)76(117)96-30-16-21-56(96)72(113)89-51(34-40(3)4)69(110)87-49(25-27-60(101)102)66(107)85-47(20-15-29-84-79(81)82)65(106)88-53(36-42(7)8)71(112)95-63(45(13)99)74(115)91-52(35-41(5)6)70(111)93-55(78(119)120)38-61(103)104/h39-58,62-63,83,99H,14-38H2,1-13H3,(H2,80,100)(H,85,107)(H,86,109)(H,87,110)(H,88,106)(H,89,113)(H,90,114)(H,91,115)(H,92,108)(H,93,111)(H,94,105)(H,95,112)(H,101,102)(H,103,104)(H,119,120)(H4,81,82,84)/t45-,46+,47+,48+,49+,50+,51+,52+,53+,54+,55+,56+,57+,58+,62+,63+/m1/s1
InChiKey: InChIKey=JINNKZRMZFNNMP-MYWIHEBGSA-N

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