BAX BH3 (58-71)

CAS No.
CCD No.
CCD00949448
Formula
C68 H119 N19 O24 S
MolWeight
1618.86

Basic Information

Product Name: BAX BH3 (58-71)
English Synonyms: BAX BH3 (58-71) ; KLSECLKRIGDELD ; H-LYS-LEU-SER-GLU-CYS-LEU-LYS-ARG-ILE-GLY-ASP-GLU-LEU-ASP-OH
MDL Number.: MFCD10567309
H bond acceptor: 43
H bond donor: 25
Smile: CC[C@H](C)[C@@H](C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)N
InChi: InChI=1S/C68H119N19O24S/c1-9-36(8)54(66(109)75-30-49(89)76-45(28-52(94)95)63(106)79-40(18-20-50(90)91)57(100)82-44(27-35(6)7)61(104)84-46(67(110)111)29-53(96)97)87-59(102)39(17-14-24-74-68(72)73)77-56(99)38(16-11-13-23-70)78-60(103)43(26-34(4)5)83-65(108)48(32-112)86-58(101)41(19-21-51(92)93)80-64(107)47(31-88)85-62(105)42(25-33(2)3)81-55(98)37(71)15-10-12-22-69/h33-48,54,88,112H,9-32,69-71H2,1-8H3,(H,75,109)(H,76,89)(H,77,99)(H,78,103)(H,79,106)(H,80,107)(H,81,98)(H,82,100)(H,83,108)(H,84,104)(H,85,105)(H,86,101)(H,87,102)(H,90,91)(H,92,93)(H,94,95)(H,96,97)(H,110,111)(H4,72,73,74)/t36-,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,54-/m0/s1
InChiKey: InChIKey=JEIPVNFRNQSLDW-OZWLICTPSA-N

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