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CHEBI:190693 - substance P(1-9)(2+)

ChEBI IDCHEBI:190693
ChEBI Namesubstance P(1-9)(2+)
Stars
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC52H79N15O12
Net Charge+2
Average Mass1106.297
Monoisotopic Mass1105.60217
SMILESNC(=[NH2+])NCCC[C@H]([NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCC[NH3+])C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)[O-]
InChIInChI=1S/C52H77N15O12/c53-24-8-7-17-36(63-49(77)39-18-10-26-66(39)50(78)33(54)16-9-25-59-52(57)58)51(79)67-27-11-19-40(67)48(76)62-35(21-23-42(56)69)45(73)61-34(20-22-41(55)68)46(74)65-38(29-32-14-5-2-6-15-32)47(75)64-37(44(72)60-30-43(70)71)28-31-12-3-1-4-13-31/h1-6,12-15,33-40H,7-11,16-30,53-54H2,(H2,55,68)(H2,56,69)(H,60,72)(H,61,73)(H,62,76)(H,63,77)(H,64,75)(H,65,74)(H,70,71)(H4,57,58,59)/p+2/t33-,34-,35-,36-,37-,38-,39-,40-/m0/s1
InChIKeyFVHHQLNFRHVTSN-TZPCGENMSA-P
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
substance P(1-9)(2+) (CHEBI:190693) has functional parent substance P(3+) (CHEBI:190692)
substance P(1-9)(2+) (CHEBI:190693) is a oligopeptide (CHEBI:25676)
Synonyms  Source
L-Arg-L-Pro-L-Lys-L-Pro-L-Gln-L-Gln-L-Phe-L-Phe-GlySUBMITTER
RPKPQQFFGSUBMITTER
UniProt Name  Source
substance P(1-9)UniProt
Citations