ASDYKSAHKGLKGVDAQGTLSKIFK

CAS No.
CCD No.
CCD01020570
Formula
C118 H193 N33 O36
MolWeight
2650.02

Basic Information

Product Name: ASDYKSAHKGLKGVDAQGTLSKIFK
English Synonyms: ASDYKSAHKGLKGVDAQGTLSKIFK ; H-ALA-SER-ASP-TYR-LYS-SER-ALA-HIS-LYS-GLY-LEU-LYS-GLY-VAL-ASP-ALA-GLN-GLY-THR-LEU-SER-LYS-ILE-PHE-LYS-OH ; MBP (131-155)
MDL Number.: MFCD11113675
H bond acceptor: 69
H bond donor: 40
Smile: CC[C@H](C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)CNC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]cn2)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccc(cc3)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](C)N
InChi: InChI=1S/C118H193N33O36/c1-13-63(8)95(116(184)144-81(47-68-27-15-14-16-28-68)109(177)139-77(118(186)187)33-21-26-44-123)151-104(172)75(32-20-25-43-122)138-113(181)87(58-154)148-107(175)79(46-61(4)5)143-117(185)96(67(12)155)150-91(160)55-129-102(170)76(38-39-88(125)157)134-98(166)65(10)131-105(173)83(50-92(161)162)145-115(183)94(62(6)7)149-90(159)54-128-101(169)72(29-17-22-40-119)135-106(174)78(45-60(2)3)133-89(158)53-127-100(168)73(30-18-23-41-120)136-110(178)82(49-70-52-126-59-130-70)140-99(167)66(11)132-112(180)85(56-152)147-103(171)74(31-19-24-42-121)137-108(176)80(48-69-34-36-71(156)37-35-69)141-111(179)84(51-93(163)164)142-114(182)86(57-153)146-97(165)64(9)124/h14-16,27-28,34-37,52,59-67,72-87,94-96,152-156H,13,17-26,29-33,38-51,53-58,119-124H2,1-12H3,(H2,125,157)(H,126,130)(H,127,168)(H,128,169)(H,129,170)(H,131,173)(H,132,180)(H,133,158)(H,134,166)(H,135,174)(H,136,178)(H,137,176)(H,138,181)(H,139,177)(H,140,167)(H,141,179)(H,142,182)(H,143,185)(H,144,184)(H,145,183)(H,146,165)(H,147,171)(H,148,175)(H,149,159)(H,150,160)(H,151,172)(H,161,162)(H,163,164)(H,186,187)/t63-,64-,65-,66-,67+,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,94-,95-,96-/m0/s1
InChiKey: InChIKey=PLARAWMVQJVGLY-YDEQCWGBSA-N

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