Molecular Structure:
CCD No.:CCD04011646
GLEQLESIINFEKL
Formula:C74 H121 N17 O24
MolWeight:1632.86
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| Product Name： | GLEQLESIINFEKL |
| English Synonyms： | GLEQLESIINFEKL ; N6-SIINKEFL, OVA (251-264) |
| MDL Number.： | MFCD18252002 |
| H bond acceptor： | 41 |
| H bond donor： | 22 |
| Smile： | CC[C@H](C)[C@@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)CN |
| InChi： | InChI=1S/C74H121N17O24/c1-11-40(9)60(72(112)87-51(34-55(78)94)70(110)86-50(33-42-18-14-13-15-19-42)69(109)84-45(22-26-57(96)97)63(103)80-43(20-16-17-29-75)62(102)88-52(74(114)115)32-39(7)8)91-73(113)61(41(10)12-2)90-71(111)53(36-92)89-66(106)47(24-28-59(100)101)83-68(108)49(31-38(5)6)85-65(105)44(21-25-54(77)93)81-64(104)46(23-27-58(98)99)82-67(107)48(30-37(3)4)79-56(95)35-76/h13-15,18-19,37-41,43-53,60-61,92H,11-12,16-17,20-36,75-76H2,1-10H3,(H2,77,93)(H2,78,94)(H,79,95)(H,80,103)(H,81,104)(H,82,107)(H,83,108)(H,84,109)(H,85,105)(H,86,110)(H,87,112)(H,88,102)(H,89,106)(H,90,111)(H,91,113)(H,96,97)(H,98,99)(H,100,101)(H,114,115)/t40-,41-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,60-,61-/m0/s1 |
| InChiKey： | InChIKey=PUCMNNFRONMYEC-XRRKYQIESA-N |
Basic Information
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