Basic Information |
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Product Name: | ALPHA-CONOTOXIN IMI |
CAS: | 156467-85-5 |
English Synonyms: | GLY-CYS-CYS-SER-ASP-PRO-ARG-CYS-ALA-TRP-ARG-CYS-NH2 ; ALPHA-CONOTOXIN IMI ; H-GLY-CYS-CYS-SER-ASP-PRO-ARG-CYS-ALA-TRP-ARG-CYS-NH2 (CYS2-CYS8, CYS3-CYS12) ; CONUS VENUM ; [CYS2-CYS8, CYS3-CYS12] H2N-GLY-CYS-CYS-SER-ASP-PRO-ARG-CYS-ALA-TRP-ARG-CYS-NH2 ; A-CONOTOXIN IMI |
MDL Number.: | MFCD07366679 |
H bond acceptor: | 35 |
H bond donor: | 21 |
Smile: | C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N2)NC(=O)CN)C(=O)N1)CCCNC(=N)N)CC(=O)O)CO)C(=O)N)CCCNC(=N)N)Cc4c[nH]c5c4cccc5 |
InChi: | InChI=1S/C52H78N20O15S4/c1-24-41(78)66-30(15-25-18-61-27-8-3-2-7-26(25)27)44(81)64-28(9-4-12-59-51(55)56)42(79)69-33(40(54)77)20-88-90-23-36-48(85)68-32(19-73)45(82)67-31(16-39(75)76)50(87)72-14-6-11-37(72)49(86)65-29(10-5-13-60-52(57)58)43(80)70-35(46(83)62-24)22-91-89-21-34(47(84)71-36)63-38(74)17-53/h2-3,7-8,18,24,28-37,61,73H,4-6,9-17,19-23,53H2,1H3,(H2,54,77)(H,62,83)(H,63,74)(H,64,81)(H,65,86)(H,66,78)(H,67,82)(H,68,85)(H,69,79)(H,70,80)(H,71,84)(H,75,76)(H4,55,56,59)(H4,57,58,60)/t24-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37-/m0/s1 |
InChiKey: | InChIKey=AIKMSOHWSGWCNX-VAYQAVKTSA-N |
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