basic_info |
|
| Product_Name： | APIDAECIN IB |
| EnglishSynonyms： | H-GLY-ASN-ASN-ARG-PRO-VAL-TYR-ILE-PRO-GLN-PRO-ARG-PRO-PRO-HIS-PRO-ARG-LEU-OH ; APIDAECIN-1B ; GNNRPVYIPQPRPPHPRL ; APIDAECIN IB |
| pro_mdlNumber： | MFCD09842405 |
| pro_acceptors： | 55 |
| pro_donors： | 27 |
| pro_smile： | CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)N)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCNC(=N)N)C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N[C@@H](Cc5c[nH]cn5)C(=O)N6CCC[C@H]6C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](Cc7ccc(cc7)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H]8CCCN8C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)CN |
| InChi： | InChI=1S/C95H150N32O23/c1-7-51(6)75(121-79(136)59(42-52-26-28-54(128)29-27-52)117-85(142)74(50(4)5)120-84(141)68-24-13-36-123(68)86(143)56(18-9-33-108-94(102)103)113-78(135)61(45-72(99)131)116-77(134)60(44-71(98)130)111-73(132)46-96)91(148)126-39-15-23-67(126)82(139)115-58(30-31-70(97)129)88(145)122-35-11-21-65(122)81(138)114-57(19-10-34-109-95(104)105)87(144)127-40-16-25-69(127)90(147)125-38-14-22-66(125)83(140)118-62(43-53-47-106-48-110-53)89(146)124-37-12-20-64(124)80(137)112-55(17-8-32-107-93(100)101)76(133)119-63(92(149)150)41-49(2)3/h26-29,47-51,55-69,74-75,128H,7-25,30-46,96H2,1-6H3,(H2,97,129)(H2,98,130)(H2,99,131)(H,106,110)(H,111,132)(H,112,137)(H,113,135)(H,114,138)(H,115,139)(H,116,134)(H,117,142)(H,118,140)(H,119,133)(H,120,141)(H,121,136)(H,149,150)(H4,100,101,107)(H4,102,103,108)(H4,104,105,109)/t51-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,68-,69-,74-,75-/m0/s1 |
| InChiKey： | InChIKey=NUTHXVZQNRZFPR-FHDGIMILSA-N |
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