CHEBI:32017 - Pirmenol hydrochloride

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ChEBI Name Pirmenol hydrochloride
ChEBI ID CHEBI:32017
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formulae C22H30N2O.HCl
C22H33ClN2O2
Net Charge 0
Average Mass 392.963
Monoisotopic Mass 392.22306
InChI InChI=1S/C22H30N2O.ClH.H2O/c1-18-10-8-11-19(2)24(18)17-9-15-22(25,20-12-4-3-5-13-20)21-14-6-7-16-23-21;;/h3-7,12-14,16,18-19,25H,8-11,15,17H2,1-2H3;1H;1H2/t18-,19+,22?;;
InChIKey GYTCSFJBULWQKM-RBNUEXKJSA-N
SMILES C=1C=C(C(CCCN2[C@H](CCC[C@H]2C)C)(C=3N=CC=CC3)O)C=CC1.Cl.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 Pirmenol hydrochloride (CHEBI:32017) is a benzenes (CHEBI:22712)
Pirmenol hydrochloride (CHEBI:32017) is a organic amino compound (CHEBI:50047)
Synonym Source
Pirmenol hydrochloride KEGG COMPOUND
Manual Xref Database
D01785 KEGG DRUG
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Registry Number Type Source
61477-94-9 CAS Registry Number KEGG COMPOUND
Last Modified
06 March 2017