CHEBI:174695 - 2-Hydroxynevirapine

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 2-Hydroxynevirapine
ChEBI ID CHEBI:174695
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H14N4O2
Net Charge 0
Average Mass 282.303
Monoisotopic Mass 282.11168
InChI InChI=1S/C15H14N4O2/c1-8-7-11(20)17-14-12(8)18-15(21)10-3-2-6-16-13(10)19(14)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3,(H,17,20)(H,18,21)
InChIKey LFZSOJABLBVGRJ-UHFFFAOYSA-N
SMILES O=C1NC2=C(N(C3CC3)C=4N=CC=CC41)NC(=O)C=C2C
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-Hydroxynevirapine (CHEBI:174695) is a aromatic amine (CHEBI:33860)
2-Hydroxynevirapine (CHEBI:174695) is a tertiary amino compound (CHEBI:50996)
IUPAC Name
2-cyclopropyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),6,12,14-pentaene-5,10-dione
Manual Xrefs Databases
9025755 ChemSpider
HMDB0013912 HMDB
View more database links
Registry Number Type Source
254889-31-1 CAS Registry Number ChemIDplus