Basic Information |
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Product Name: | (HIS)(SER)(ASP)(GLY)(LEU)(PHE)(THR)(SER)(GLU)(TYR)(SER)(LYS)(MET)(ARG)(GLY)(ASN)(ALA)(GLN)(VAL)(GLN)(LYS)(PHE)(ILE)(GLN)(ASN)(LEU)(MET)-NH2 |
English Synonyms: | SECRETIN, CHICKEN ; (HIS)(SER)(ASP)(GLY)(LEU)(PHE)(THR)(SER)(GLU)(TYR)(SER)(LYS)(MET)(ARG)(GLY)(ASN)(ALA)(GLN)(VAL)(GLN)(LYS)(PHE)(ILE)(GLN)(ASN)(LEU)(MET)-NH2 ; HSDGLFTSEYSKMRGNAQVQKFIQNLM-NH2 |
MDL Number.: | MFCD00167923 |
H bond acceptor: | 81 |
H bond donor: | 46 |
Smile: | CC[C@H](C)[C@@H](C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C)NC(=O)[C@H](CC(=O)N)NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)C([C@@H](C)O)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc4c[nH]cn4)N |
InChi: | InChI=1S/C136H214N40O41S2/c1-13-70(8)109(134(216)164-84(37-41-100(141)183)119(201)169-94(58-103(144)186)127(209)165-89(52-68(4)5)125(207)156-79(111(145)193)44-49-218-11)175-128(210)91(53-73-25-16-14-17-26-73)167-117(199)82(30-21-23-47-138)159-118(200)83(36-40-99(140)182)163-133(215)108(69(6)7)174-122(204)85(38-42-101(142)184)157-112(194)71(9)153-123(205)93(57-102(143)185)155-105(188)61-150-114(196)80(31-24-48-149-136(146)147)158-121(203)87(45-50-219-12)162-116(198)81(29-20-22-46-137)160-130(212)97(64-178)172-126(208)90(55-75-32-34-77(181)35-33-75)166-120(202)86(39-43-106(189)190)161-131(213)98(65-179)173-135(217)110(72(10)180)176-129(211)92(54-74-27-18-15-19-28-74)168-124(206)88(51-67(2)3)154-104(187)62-151-115(197)95(59-107(191)192)170-132(214)96(63-177)171-113(195)78(139)56-76-60-148-66-152-76/h14-19,25-28,32-35,60,66-72,78-98,108-110,177-181H,13,20-24,29-31,36-59,61-65,137-139H2,1-12H3,(H2,140,182)(H2,141,183)(H2,142,184)(H2,143,185)(H2,144,186)(H2,145,193)(H,148,152)(H,150,196)(H,151,197)(H,153,205)(H,154,187)(H,155,188)(H,156,207)(H,157,194)(H,158,203)(H,159,200)(H,160,212)(H,161,213)(H,162,198)(H,163,215)(H,164,216)(H,165,209)(H,166,202)(H,167,199)(H,168,206)(H,169,201)(H,170,214)(H,171,195)(H,172,208)(H,173,217)(H,174,204)(H,175,210)(H,176,211)(H,189,190)(H,191,192)(H4,146,147,149)/t70-,71-,72+,78-,79-,80-,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,108-,109-,110?/m0/s1 |
InChiKey: | InChIKey=BGDZFWYUYMOJJG-QYPZDKSJSA-N |
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