CHEBI:31864 - Montirelin

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ChEBI Name Montirelin
ChEBI ID CHEBI:31864
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C17H24N6O4S
C17H24N6O4S
Net Charge 0
Average Mass 408.477
Monoisotopic Mass 408.15797
InChI InChI=1S/C17H24N6O4S/c1-9-15(25)22-12(7-28-9)16(26)21-11(5-10-6-19-8-20-10)17(27)23-4-2-3-13(23)14(18)24/h6,8-9,11-13H,2-5,7H2,1H3,(H2,18,24)(H,19,20)(H,21,26)(H,22,25)/t9-,11+,12+,13+/m1/s1
InChIKey RSHMQGIMHQPMEB-IXOXFDKPSA-N
SMILES C=1(NC=NC1)C[C@@H](C(N2[C@@H](CCC2)C(=O)N)=O)NC([C@H]3NC([C@H](SC3)C)=O)=O
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing Montirelin (CHEBI:31864) is a oligopeptide (CHEBI:25676)
Synonym Source
Montirelin KEGG COMPOUND
Manual Xref Database
D02588 KEGG DRUG
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Registry Number Type Source
90243-66-6 CAS Registry Number KEGG COMPOUND
Last Modified
11 May 2017