CHEBI:91179 - indolmycin(1+)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name indolmycin(1+)
ChEBI ID CHEBI:91179
Definition An organic cation obtained by protonation at position 3 in the oxazole ring of indolmycin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C14H16N3O2
Net Charge +1
Average Mass 258.296
Monoisotopic Mass 258.12370
InChI InChI=1S/C14H15N3O2/c1-8(12-13(18)17-14(15-2)19-12)10-7-16-11-6-4-3-5-9(10)11/h3-8,12,16H,1-2H3,(H,15,17,18)/p+1/t8-,12+/m1/s1
InChIKey GNTVWGDQPXCYBV-PELKAZGASA-O
SMILES C12=CC=CC=C1C(=CN2)[C@@H](C)[C@]3(C([NH+]=C(O3)NC)=O)[H]
ChEBI Ontology
Outgoing indolmycin(1+) (CHEBI:91179) is a organic cation (CHEBI:25697)
indolmycin(1+) (CHEBI:91179) is conjugate acid of indolmycin (CHEBI:79394)
Incoming indolmycin (CHEBI:79394) is conjugate base of indolmycin(1+) (CHEBI:91179)
Synonyms Sources
indolmycin UniProt
indolmycin cation ChEBI
Manual Xref Database
CPD0-920 MetaCyc
View more database links
Last Modified
11 April 2016