EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:216894 - Microansamycin C

ChEBI IDCHEBI:216894
ChEBI NameMicroansamycin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H19NO5
Net Charge0
Average Mass317.341
Monoisotopic Mass317.12632
SMILESC[C@@H]1C[C@H]2O[C@@]34C(=CC(=O)C=C3NC(=O)[C@@]4(C)C1=O)CC[C@@H]2O
InChIInChI=1S/C17H19NO5/c1-8-5-12-11(20)4-3-9-6-10(19)7-13-17(9,23-12)16(2,14(8)21)15(22)18-13/h6-8,11-12,20H,3-5H2,1-2H3,(H,18,22)/t8-,11+,12-,16-,17+/m1/s1
InChIKeyQBBKKZZMOITPHB-FWPSNLPTSA-N
Species of MetaboliteComponentSourceComments
Micromonosporaspecies (ncbitaxon:1876) - PubMed (29412682)
ChEBI Ontology
Outgoing Relation(s)
Microansamycin C (CHEBI:216894) is a indoles (CHEBI:24828)
IUPAC Name 
(1R,2S,12R,14R,17R)-2-hydroxy-12,14-dimethyl-16-oxa-10-azatetracyclo[7.6.2.05,17.012,17]heptadeca-5,8-diene-7,11,13-trione