basic_info |
|
| Product_Name: | BIOTIN-BETA-AMYLOID (18-28) |
| EnglishSynonyms: | BIOTIN-BETA-AMYLOID (18-28) ; BIOTIN-VAL-PHE-PHE-ALA-GLU-ASP-VAL-GLY-SER-ASN-LYS-OH ; BIOTIN-VFFAEDVGSNK |
| pro_mdlNumber: | MFCD13185198 |
| pro_acceptors: | 35 |
| pro_donors: | 19 |
| pro_smile: | CC(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)CCCC[C@H]3[C@@H]4[C@H](CS3)NC(=O)N4 |
| InChi: | InChI=1S/C65H95N15O20S/c1-33(2)52(62(96)68-30-49(84)70-44(31-81)61(95)74-42(28-47(67)82)59(93)72-39(64(98)99)20-14-15-25-66)79-60(94)43(29-51(87)88)75-56(90)38(23-24-50(85)86)71-55(89)35(5)69-57(91)40(26-36-16-8-6-9-17-36)73-58(92)41(27-37-18-10-7-11-19-37)76-63(97)53(34(3)4)78-48(83)22-13-12-21-46-54-45(32-101-46)77-65(100)80-54/h6-11,16-19,33-35,38-46,52-54,81H,12-15,20-32,66H2,1-5H3,(H2,67,82)(H,68,96)(H,69,91)(H,70,84)(H,71,89)(H,72,93)(H,73,92)(H,74,95)(H,75,90)(H,76,97)(H,78,83)(H,79,94)(H,85,86)(H,87,88)(H,98,99)(H2,77,80,100)/t35-,38-,39-,40-,41-,42-,43-,44-,45-,46-,52-,53-,54-/m0/s1 |
| InChiKey: | InChIKey=HCJDKZQLZSVLEO-WSQNBYCOSA-N |
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