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CHEBI:136715 - Asn-Pro-Val-Val-His-Phe-Phe-Lys-Asn-Ile-Val-Thr-Pro-Arg-Thr-Pro-Pro-Pro-Ser

ChEBI IDCHEBI:136715
ChEBI NameAsn-Pro-Val-Val-His-Phe-Phe-Lys-Asn-Ile-Val-Thr-Pro-Arg-Thr-Pro-Pro-Pro-Ser
Stars
DefinitionAn oligopeptide composed of L-asparagine, L-proline, L-valine, L-valine, L-histidine, L-phenylalanine, L-phenylalanine, L-lysine, L-asparagine, L-isoleucine, L-valine, L-threonine, L-proline, L-arginine, L-threonine, L-proline, L-proline, L-proline and L-serine joined in sequence by peptide linkages.
Last Modified4 April 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC101H155N27O25
Net Charge0
Average Mass2147.515
Monoisotopic Mass2146.16874
SMILESCCC(C)[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(N)=O)C(C)C)C(C)C)C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O)C(C)O)C(C)O)C(C)C
InChIInChI=1S/C101H155N27O25/c1-11-55(8)79(94(146)120-78(54(6)7)93(145)123-81(57(10)131)98(150)126-41-23-33-70(126)88(140)112-63(31-20-38-109-101(106)107)83(135)122-80(56(9)130)99(151)128-43-25-36-73(128)97(149)127-42-24-35-72(127)96(148)125-40-22-32-69(125)89(141)117-68(50-129)100(152)153)121-87(139)67(48-75(105)133)115-82(134)62(30-18-19-37-102)111-84(136)64(44-58-26-14-12-15-27-58)113-85(137)65(45-59-28-16-13-17-29-59)114-86(138)66(46-60-49-108-51-110-60)116-91(143)76(52(2)3)119-92(144)77(53(4)5)118-90(142)71-34-21-39-124(71)95(147)61(103)47-74(104)132/h12-17,26-29,49,51-57,61-73,76-81,129-131H,11,18-25,30-48,50,102-103H2,1-10H3,(H2,104,132)(H2,105,133)(H,108,110)(H,111,136)(H,112,140)(H,113,137)(H,114,138)(H,115,134)(H,116,143)(H,117,141)(H,118,142)(H,119,144)(H,120,146)(H,121,139)(H,122,135)(H,123,145)(H,152,153)(H4,106,107,109)/t55?,56?,57?,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,76-,77-,78-,79-,80-,81-/m0/s1
InChIKeyJEEOACDVCJGQKG-QZOXXEBHSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Asn-Pro-Val-Val-His-Phe-Phe-Lys-Asn-Ile-Val-Thr-Pro-Arg-Thr-Pro-Pro-Pro-Ser (CHEBI:136715) is a oligopeptide (CHEBI:25676)
IUPAC Name 
L-asparaginyl-L-prolyl-L-valyl-L-valyl-L-histidyl-L-phenylalanyl-L-phenylalanyl-L-lysyl-L-asparaginyl-L-isoleucyl-L-valyl-L-threonyl-L-prolyl-L-arginyl-L-threonyl-L-prolyl-L-prolyl-L-prolyl-L-serine
Synonyms  Source
NPVVHFFKNIVTPRTPPPSChEBI
L-Asn-L-Pro-L-Val-L-Val-L-His-L-Phe-L-Phe-L-Lys-L-Asn-L-Ile-L-Val-L-Thr-L-Pro-L-Arg-L-Thr-L-Pro-L-Pro-L-Pro-L-SerChEBI
N-P-V-V-H-F-F-K-N-I-V-T-P-R-T-P-P-P-SJCBN
Citations