Endogenous peptide in human, mouse or rat

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  1. PKI 14-22 amide,myristoylated TFA, Inhibitor of protein kinase A
    Cas#: 201422-03-9        Compound CID:  71312213
    Formula:  C53H100N20O12(free)        Molecular Weight: 1209.49(free)
    IUPAC Name: (2S)-N-[(2S)-1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]-2-[[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-[[(2S,3R)-2-[[(2S)-5-(diaminomethylideneamino)-2-[[2-(tetradecanoylamino)acetyl]amino]pentanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]pentanoyl]amino]pentanoyl]amino]butanediamide
    SMILES: CCCCCCCCCCCCCC(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NC(C(C)O)C(=O)NCC(=O)NC(CCCN=C(N)N)C(=O)NC(CCCN=C(N)N)C(=O)NC(CC(=O)N)C(=O)NC(C)C(=O)NC(C(C)CC)C(=O)N
    InChIKey: GQPQKQWUUHDDIS-JDLJUXOTSA-N
    InChI: InChI=1S/C53H100N20O12/c1-6-8-9-10-11-12-13-14-15-16-17-24-39(76)65-29-40(77)69-35(22-19-26-63-52(58)59)48(83)73-43(33(5)74)50(85)66-30-41(78)68-34(21-18-25-62-51(56)57)46(81)70-36(23-20-27-64-53(60)61)47(82)71-37(28-38(54)75)49(84)67-32(4)45(80)72-42(44(55)79)31(3)7-2/h31-37,42-43,74H,6-30H2,1-5H3,(H2,54,75)(H2,55,79)(H,65,76)(H,66,85)(H,67,84)(H,68,78)(H,69,77)(H,70,81)(H,71,82)(H,72,80)(H,73,83)(H4,56,57,62)(H4,58,59,63)(H4,60,61,64)/t31-,32-,33+,34-,35-,36-,37-,42-,43-/m0/s1
  2. neuropeptide W-23, Agonist of NPBW1 receptor;Agonist of NPBW2 receptor
    Cas#: 383415-89-2        Compound CID:  90472277
    IUPAC Name: (2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(1H-imidazol-4-yl)propanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]-5-carbamimidamidopentanoyl]amino]propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoyl]amino]-4-methylsulfanylbutanoyl]amino]acetyl]amino]-4-methylpentanoic acid
    SMILES: CC(C)CC(C(=O)NC(CC(C)C)C(=O)NC(CCSC)C(=O)NCC(=O)NC(CC(C)C)C(=O)O)NC(=O)CNC(=O)C(CO)NC(=O)C(C)NC(=O)C(CCCNC(=N)N)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(C(C)O)NC(=O)C(CC1=CNC=N1)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CCCNC(=N)N)NC(=O)C3CCCN3C(=O)C(CO)NC(=O)C(C)NC(=O)C(C(C)C)NC(=O)C(CC4=CNC=N4)NC(=O)C(CCCCN)NC(=O)C(CC5=CC=C(C=C5)O)NC(=O)C(CC6=CNC7=CC=CC=C76)N
    InChIKey: MVEYTZGYDLTNKF-IXEUOKQQSA-N
    InChI: InChI=1S/C119H183N35O29S/c1-60(2)42-82(106(171)145-83(43-61(3)4)107(172)142-81(36-41-184-14)101(166)131-54-94(162)140-88(117(182)183)44-62(5)6)139-93(161)53-132-102(167)89(56-155)149-98(163)65(11)136-103(168)78(25-19-38-128-118(122)123)138-92(160)55-133-113(178)95(63(7)8)152-115(180)97(67(13)157)153-111(176)87(49-72-52-127-59-135-72)148-109(174)85(46-69-30-34-74(159)35-31-69)146-105(170)80(26-20-39-129-119(124)125)143-112(177)91-27-21-40-154(91)116(181)90(57-156)150-99(164)66(12)137-114(179)96(64(9)10)151-110(175)86(48-71-51-126-58-134-71)147-104(169)79(24-17-18-37-120)141-108(173)84(45-68-28-32-73(158)33-29-68)144-100(165)76(121)47-70-50-130-77-23-16-15-22-75(70)77/h15-16,22-23,28-35,50-52,58-67,76,78-91,95-97,130,155-159H,17-21,24-27,36-49,53-57,120-121H2,1-14H3,(H,126,134)(H,127,135)(H,131,166)(H,132,167)(H,133,178)(H,136,168)(H,137,179)(H,138,160)(H,139,161)(H,140,162)(H,141,173)(H,142,172)(H,143,177)(H,144,165)(H,145,171)(H,146,170)(H,147,169)(H,148,174)(H,149,163)(H,150,164)(H,151,175)(H,152,180)(H,153,176)(H,182,183)(H4,122,123,128)(H4,124,125,129)/t65-,66-,67+,76-,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,95-,96-,97-/m0/s1
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