CHEBI:209470 - Cytorhizin D

ChEBI IDCHEBI:209470
ChEBI NameCytorhizin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O8
Net Charge0
Average Mass442.464
Monoisotopic Mass442.16277
SMILESCC(=O)OC[C@H]1O[C@]23Oc4cccc(O)c4[C@](O)(c4c(O)cc(C)c(c42)OC1(C)C)[C@H]3C
InChIInChI=1S/C24H26O8/c1-11-9-15(27)19-20-21(11)32-22(4,5)17(10-29-13(3)25)31-24(20)12(2)23(19,28)18-14(26)7-6-8-16(18)30-24/h6-9,12,17,26-28H,10H2,1-5H3/t12-,17-,23+,24+/m1/s1
InChIKeyNTLDKJCPDFLPTP-ZXKSQTTKSA-N
Species of MetaboliteComponentSourceComments
Cytospora (ncbitaxon:117544) - PubMed (30726094)
ChEBI Ontology
Outgoing Relation(s)
Cytorhizin D (CHEBI:209470) is a dibenzooxazepine (CHEBI:53802)
IUPAC Name 
[(1R,9R,17R,20R)-7,9,11-trihydroxy-13,16,16,20-tetramethyl-2,15,18-trioxapentacyclo[8.8.1.11,9.03,8.014,19]icosa-3,5,7,10,12,14(19)-hexaen-17-yl]methyl acetate