H-LEU-ASP-LEU-ASN-LEU-GLU-LEU-SER-LYS-PHE-ARG-MET-PRO-GLN-PRO-SER-SER-GLY-ARG-GLU-SER-PRO-ARG-HIS-OH TRIFLUOROACETATE SALT

CAS No.
CCD No.
CCD04335864
Formula
C120 H196 N38 O37 S . C2 H F3 O2
MolWeight
2909.19

Basic Information

Product Name: H-LEU-ASP-LEU-ASN-LEU-GLU-LEU-SER-LYS-PHE-ARG-MET-PRO-GLN-PRO-SER-SER-GLY-ARG-GLU-SER-PRO-ARG-HIS-OH TRIFLUOROACETATE SALT
English Synonyms: OSTEOBLAST ACTIVATING PEPTIDE (HUMAN) TRIFLUOROACETATE SALT ; OBAP (HUMAN) TRIFLUOROACETATE SALT ; H-LEU-ASP-LEU-ASN-LEU-GLU-LEU-SER-LYS-PHE-ARG-MET-PRO-GLN-PRO-SER-SER-GLY-ARG-GLU-SER-PRO-ARG-HIS-OH TRIFLUOROACETATE SALT
MDL Number.: MFCD18643376
H bond acceptor: 75
H bond donor: 42
Smile: CC(C)C[C@@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCSC)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCC(=O)N)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc5c[nH]cn5)C(=O)O)N.C(=O)(C(F)(F)F)O
InChi: InChI=1S/C120H196N38O37S.C2HF3O2/c1-60(2)45-66(122)95(172)145-80(52-94(170)171)108(185)148-76(47-62(5)6)104(181)150-79(51-90(124)164)107(184)147-75(46-61(3)4)103(180)141-71(31-34-92(166)167)101(178)146-77(48-63(7)8)105(182)153-83(56-160)109(186)139-68(23-13-14-37-121)99(176)149-78(49-64-21-11-10-12-22-64)106(183)138-69(25-16-39-133-119(127)128)98(175)143-74(36-44-196-9)115(192)157-42-18-28-87(157)112(189)144-73(30-33-89(123)163)114(191)156-41-19-29-88(156)113(190)154-84(57-161)110(187)152-82(55-159)96(173)135-54-91(165)137-67(24-15-38-132-118(125)126)97(174)140-72(32-35-93(168)169)102(179)155-85(58-162)116(193)158-43-20-27-86(158)111(188)142-70(26-17-40-134-120(129)130)100(177)151-81(117(194)195)50-65-53-131-59-136-65;3-2(4,5)1(6)7/h10-12,21-22,53,59-63,66-88,159-162H,13-20,23-52,54-58,121-122H2,1-9H3,(H2,123,163)(H2,124,164)(H,131,136)(H,135,173)(H,137,165)(H,138,183)(H,139,186)(H,140,174)(H,141,180)(H,142,188)(H,143,175)(H,144,189)(H,145,172)(H,146,178)(H,147,184)(H,148,185)(H,149,176)(H,150,181)(H,151,177)(H,152,187)(H,153,182)(H,154,190)(H,155,179)(H,166,167)(H,168,169)(H,170,171)(H,194,195)(H4,125,126,132)(H4,127,128,133)(H4,129,130,134);(H,6,7)/t66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-;/m0./s1
InChiKey: InChIKey=WOZXHCGSHJBWRD-UYQZPQSGSA-N

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