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CHEBI:90830 - VSWKTWFPNLAV

ChEBI IDCHEBI:90830
ChEBI NameVSWKTWFPNLAV
Stars
DefinitionA twelve-membered polypeptide comprising the sequence Val-Ser-Trp-Lys-Thr-Trp-Phe-Pro-Asn-Leu-Ala-Val.
Last Modified4 January 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC72H102N16O16
Net Charge0
Average Mass1447.704
Monoisotopic Mass1446.76597
SMILESCC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@H](CO)NC(=O)[C@@H](N)C(C)C)C(C)O)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)C(C)C
InChIInChI=1S/C72H102N16O16/c1-37(2)29-50(63(94)78-40(7)61(92)86-59(39(5)6)72(103)104)80-66(97)53(33-57(74)91)82-68(99)56-26-18-28-88(56)71(102)54(30-42-19-10-9-11-20-42)84-65(96)52(32-44-35-77-48-24-15-13-22-46(44)48)83-70(101)60(41(8)90)87-62(93)49(25-16-17-27-73)79-64(95)51(31-43-34-76-47-23-14-12-21-45(43)47)81-67(98)55(36-89)85-69(100)58(75)38(3)4/h9-15,19-24,34-35,37-41,49-56,58-60,76-77,89-90H,16-18,25-33,36,73,75H2,1-8H3,(H2,74,91)(H,78,94)(H,79,95)(H,80,97)(H,81,98)(H,82,99)(H,83,101)(H,84,96)(H,85,100)(H,86,92)(H,87,93)(H,103,104)/t40-,41?,49-,50-,51-,52-,53-,54-,55-,56-,58-,59-,60-/m0/s1
InChIKeyZYKYLICTRPPEAR-YNVYRQEYSA-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)
VSWKTWFPNLAV (CHEBI:90830) is a polypeptide (CHEBI:15841)
IUPAC Name 
L-valyl-L-seryl-L-tryptophyl-L-lysyl-L-threonyl-L-tryptophyl-L-phenylalanyl-L-prolyl-L-asparaginyl-L-leucyl-L-alanyl-L-valine
Synonyms  Source
L-Val-L-Ser-L-Trp-L-Lys-L-Thr-L-Trp-L-Phe-L-Pro-L-Asn-L-Leu-L-Ala-L-ValChEBI
Val-Ser-Trp-Lys-Thr-Trp-Phe-Pro-Asn-Leu-Ala-ValJCBN
Citations