CHEBI:107315 - 2-[[6-amino-2-(3-methylanilino)-5-nitro-4-pyrimidinyl]amino]ethanol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-[[6-amino-2-(3-methylanilino)-5-nitro-4-pyrimidinyl]amino]ethanol
ChEBI ID CHEBI:107315
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C13H16N6O3
Net Charge 0
Average Mass 304.305
Monoisotopic Mass 304.12839
InChI InChI=1S/C13H16N6O3/c1-8-3-2-4-9(7-8)16-13-17-11(14)10(19(21)22)12(18-13)15-5-6-20/h2-4,7,20H,5-6H2,1H3,(H4,14,15,16,17,18)
InChIKey SULPMJJSBUTHBD-UHFFFAOYSA-N
SMILES CC1=CC(=CC=C1)NC2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N
ChEBI Ontology
Outgoing 2-[[6-amino-2-(3-methylanilino)-5-nitro-4-pyrimidinyl]amino]ethanol (CHEBI:107315) is a C-nitro compound (CHEBI:35716)
Manual Xref Database
LSM-18669 LINCS
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