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CHEBI:90938 - DASKALRSSGMP

ChEBI IDCHEBI:90938
ChEBI NameDASKALRSSGMP
Stars
DefinitionA twelve-membered polypeptide comprising the sequence Asp-Ala-Ser-Lys-Ala-Lys-Arg-Ser-Ser-Gly-Met-Pro.
Last Modified13 January 2016
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC49H87N17O18S
Net Charge0
Average Mass1234.403
Monoisotopic Mass1233.61357
SMILESCSCC[C@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(=O)O)C(=O)N1CCC[C@H]1C(=O)O
InChIInChI=1S/C49H87N17O18S/c1-25(57-40(75)27(52)20-37(71)72)39(74)63-33(23-68)45(80)62-28(10-4-6-15-50)42(77)58-26(2)38(73)60-29(11-5-7-16-51)43(78)61-30(12-8-17-55-49(53)54)44(79)65-34(24-69)46(81)64-32(22-67)41(76)56-21-36(70)59-31(14-19-85-3)47(82)66-18-9-13-35(66)48(83)84/h25-35,67-69H,4-24,50-52H2,1-3H3,(H,56,76)(H,57,75)(H,58,77)(H,59,70)(H,60,73)(H,61,78)(H,62,80)(H,63,74)(H,64,81)(H,65,79)(H,71,72)(H,83,84)(H4,53,54,55)/t25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-/m0/s1
InChIKeyKIMNIYLAEQGPTG-ULPCFHQZSA-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)
DASKALRSSGMP (CHEBI:90938) is a polypeptide (CHEBI:15841)
IUPAC Name 
L-α-aspartyl-L-alanyl-L-seryl-L-lysyl-L-alanyl-L-lysyl-L-arginyl-L-seryl-L-serylglycyl-L-methionyl-L-proline
Synonyms  Source
Asp-Ala-Ser-Lys-Ala-Lys-Arg-Ser-Ser-Gly-Met-ProJCBN
L-Asp-L-Ala-L-Ser-L-Lys-L-Ala-L-Lys-L-Arg-L-Ser-L-Ser-L-Gly-L-Met-L-ProChEBI
Citations