Name: | H-PHE-LEU-HIS-GLN-GLU-ARG-MET-ASP-VAL-CYS-GLU-THR-HIS-LEU-HIS-TRP-HIS-THR-VAL-ALA-LYS-OH |
CAS: | 315229-44-8 |
Synonyms: | FLHQERMDVCETHLHWHTVAK ; APP770 (135-155) ; BETA-AMYLOID PROTEIN PRECURSOR 770 (135-155) ; H-PHE-LEU-HIS-GLN-GLU-ARG-MET-ASP-VAL-CYS-GLU-THR-HIS-LEU-HIS-TRP-HIS-THR-VAL-ALA-LYS-OH ; AMYLOID B/A4 PROTEIN PRECURSOR770 (135-155) |
MDL.: | MFCD00798770 |
H bond acceptor: | 66 |
H bond donor: | 37 |
Smile: | CC(C)C[C@@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc3c[nH]cn3)C(=O)N[C@@H](Cc4c[nH]c5c4cccc5)C(=O)N[C@@H](Cc6c[nH]cn6)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](Cc7ccccc7)N |
InChi: | InChI=1S/C116H173N35O31S2/c1-56(2)37-78(139-96(162)70(118)39-63-21-14-13-15-22-63)102(168)142-81(41-65-47-122-52-128-65)105(171)135-73(27-30-87(119)154)98(164)134-74(28-31-88(155)156)99(165)133-72(26-20-35-126-116(120)121)97(163)137-76(33-36-184-12)100(166)145-85(45-90(159)160)109(175)148-92(59(7)8)112(178)147-86(51-183)110(176)136-75(29-32-89(157)158)101(167)150-93(61(10)152)113(179)146-83(43-67-49-124-54-130-67)107(173)140-79(38-57(3)4)103(169)143-82(42-66-48-123-53-129-66)106(172)141-80(40-64-46-127-71-24-17-16-23-69(64)71)104(170)144-84(44-68-50-125-55-131-68)108(174)151-94(62(11)153)114(180)149-91(58(5)6)111(177)132-60(9)95(161)138-77(115(181)182)25-18-19-34-117/h13-17,21-24,46-50,52-62,70,72-86,91-94,127,152-153,183H,18-20,25-45,51,117-118H2,1-12H3,(H2,119,154)(H,122,128)(H,123,129)(H,124,130)(H,125,131)(H,132,177)(H,133,165)(H,134,164)(H,135,171)(H,136,176)(H,137,163)(H,138,161)(H,139,162)(H,140,173)(H,141,172)(H,142,168)(H,143,169)(H,144,170)(H,145,166)(H,146,179)(H,147,178)(H,148,175)(H,149,180)(H,150,167)(H,151,174)(H,155,156)(H,157,158)(H,159,160)(H,181,182)(H4,120,121,126)/t60-,61+,62+,70-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,91-,92-,93-,94-/m0/s1 |
InChiKey: | InChIKey=OUZWHWVFXUODDP-VPTNPDDQSA-N |
H-PHE-LEU-HIS-GLN-GLU-ARG-MET-ASP-VAL-CYS-GLU-THR-HIS-LEU-HIS-TRP-HIS-THR-VAL-ALA-LYS-OH
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