EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:217062 - Mirilactam D

ChEBI IDCHEBI:217062
ChEBI NameMirilactam D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H37NO6
Net Charge0
Average Mass471.594
Monoisotopic Mass471.26209
SMILESCC1=C/C=C/[C@@H]2O[C@H](C[C@H]2O)[C@H](O)[C@H](O)C/C=C/C=C/C=C/C(=O)N[C@@H](C)C[C@@H](O)/C=C\C=C1
InChIInChI=1S/C27H37NO6/c1-19-11-8-9-13-21(29)17-20(2)28-26(32)16-7-5-3-4-6-14-22(30)27(33)25-18-23(31)24(34-25)15-10-12-19/h3-13,15-16,20-25,27,29-31,33H,14,17-18H2,1-2H3,(H,28,32)/b5-3+,6-4+,11-8?,13-9-,15-10+,16-7+,19-12?/t20-,21-,22+,23+,24-,25+,27+/m0/s1
InChIKeyYVZXUKFSVZQXME-BQSWHSDOSA-N
Species of MetaboliteComponentSourceComments
Actinosynnema (ncbitaxon:40566) - PubMed (29863068)
ChEBI Ontology
Outgoing Relation(s)
Mirilactam D (CHEBI:217062) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1R,2R,3R,5E,7E,9E,13S,15R,16Z,22E,24S,25R)-2,3,15,25-tetrahydroxy-13,20-dimethyl-27-oxa-12-azabicyclo[22.2.1]heptacosa-5,7,9,16,18,20,22-heptaen-11-one