Preprotachykinin B (50-79)
[CAS# 148597-04-0]

Identification

• Name: Preprotachykinin B (50-79)
• Synonyms: Peptide 2, Neurokinin B; Preprotachykinin B (50-79); L-Glutamine, L-Leucyl-L-Tyrosyl-L-Alpha-Aspartyl-L-Seryl-L-Arginyl-L-Seryl-L-Isoleucyl-L-Seryl-L-Leucyl-L-Alpha-Glutamylglycyl-L-Leucyl-L-Leucyl-L-Lysyl-L-Valyl-L-Leucyl-L-Seryl-L-Lysyl-L-Alanyl-L-Seryl-L-Valylglycyl-L-Prolyl-L-Lysyl-L-Alpha-Glutamyl-L-Threonyl-L-Seryl-L-Leucyl-L-Prolyl
• Molecular Formula: C₁₄₃H₂₄₃N₃₇O₄₆
• Molecular Weight: 3216.71
• CAS Registry Number: 148597-04-0
• SMILES: [C@@H](N)(C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1[C@H](C(=O)N[C@H](C(=O)O)CCC(=O)N)CCC1)CC(C)C)CO)[C@H](O)C)CCC(=O)O)CCCCN)CCC2)C(C)C)CO)CCCCN)CO)CC(C)C)C(C)C)CCCCN)CC(C)C)CC(C)C)CCC(=O)O)CC(C)C)CO)[C@@H](C)CC)CO)CCCNC(N)=N)CO)CC(=O)O)CC3=CC=C(C=C3)O)CC(C)C
• InChI: 1S/C143H243N37O46/c1-21-77(18)113(177-134(217)102(68-186)170-120(203)86(34-28-50-151-143(149)150)158-130(213)98(64-182)172-128(211)95(60-110(196)197)166-127(210)94(59-80-37-39-81(188)40-38-80)163-116(199)82(147)53-69(2)3)139(222)173-99(65-183)131(214)165-92(56-72(8)9)125(208)159-87(42-45-108(192)193)117(200)152-61-106(190)155-90(54-70(4)5)123(206)164-91(55-71(6)7)124(207)156-85(33-24-27-49-146)121(204)176-112(76(16)17)138(221)167-93(57-73(10)11)126(209)171-97(63-181)129(212)157-83(31-22-25-47-144)118(201)154-78(19)115(198)169-101(67-185)133(216)175-111(75(14)15)137(220)153-62-107(191)179-51-29-35-103(179)135(218)161-84(32-23-26-48-145)119(202)160-88(43-46-109(194)195)122(205)178-114(79(20)187)140(223)174-100(66-184)132(215)168-96(58-74(12)13)141(224)180-52-30-36-104(180)136(219)162-89(142(225)226)41-44-105(148)189/h37-40,69-79,82-104,111-114,181-188H,21-36,41-68,144-147H2,1-20H3,(H2,148,189)(H,152,200)(H,153,220)(H,154,201)(H,155,190)(H,156,207)(H,157,212)(H,158,213)(H,159,208)(H,160,202)(H,161,218)(H,162,219)(H,163,199)(H,164,206)(H,165,214)(H,166,210)(H,167,221)(H,168,215)(H,169,198)(H,170,203)(H,171,209)(H,172,211)(H,173,222)(H,174,223)(H,175,216)(H,176,204)(H,177,217)(H,178,205)(H,192,193)(H,194,195)(H,196,197)(H,225,226)(H4,149,150,151)/t77-,78-,79+,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,111-,112-,113-,114-/m0/s1
• InChIKey: XWSPNHVNLFQTLF-XNACSIEDSA-N