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3-Hydroxynevirapine

PropertiesImage
MNX_IDMNXM117475 Image of MNXM117475
referencechebi:174697
formulaC15H14N4O2
global charge0
mol weight282.303
InChIKeyDANIONWINZEYME-UHFFFAOYSA-N
InChIInChI=1S/C15H14N4O2/c1-8-11(20)7-17-14-12(8)18-15(21)10-3-2-6-16-13(10)19(14)9-4-5-9/h2-3,6-7,9,20H,4-5H2,1H3,(H,18,21)
SMILESCC1=C(O)C=NC2=C1NC(=O)C1=CC=CN=C1N2C1CC1
MNX internals
InChI (mnx)InChI=1/C15H14N4O2/c1-8-11(20)7-17-14-12(8)18-15(21)10-3-2-6-16-13(10)19(14)9-4-5-9/h2-3,6-7,9,20H,4-5H2,1H3,(H,18,21) Image of MNXM117475
SMILES (mnx)[CH3:1][C:8]1=[C:11]([OH:20])[CH:7]=[N:17][C:14]2=[C:12]1[N:18]=[C:15]([OH:21])[C:10]1=[C:13]([N:16]=[CH:6][CH:2]=[CH:3]1)[N:19]2[CH:9]1[CH2:4][CH2:5]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:174697
chebi:174697
DANIONWINZEYME-UHFFFAOYSA-N
3-Hydroxynevirapine
2-cyclopropyl-6-hydroxy-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-10-one
hmdb:HMDB0013914
DANIONWINZEYME-UHFFFAOYSA-N
3-Hydroxynevirapine
2-cyclopropyl-6-hydroxy-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,12,14-hexaen-10-one

hmdb:HMDB13914
secondary/obsolete/fantasy identifier