CHEBI:222116 - Actinoplanone D

ChEBI IDCHEBI:222116
ChEBI NameActinoplanone D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H25NO10
Net Charge0
Average Mass535.505
Monoisotopic Mass535.14785
SMILESCO[C@@H]1C[C@@H](O)[C@@H](OC)c2oc3c4c5c(c(O)c3c(=O)c21)-c1c(cc2cc(C)nc(=O)c2c1O)C[C@@H]5OCO4
InChIInChI=1S/C28H25NO10/c1-9-4-10-5-11-6-14-17-19(15(11)21(31)16(10)28(34)29-9)23(33)20-22(32)18-13(35-2)7-12(30)24(36-3)26(18)39-27(20)25(17)38-8-37-14/h4-5,12-14,24,30-31,33H,6-8H2,1-3H3,(H,29,34)/t12-,13-,14+,24-/m1/s1
InChIKeyPGRSDWZKKHDDAE-MXLPWREJSA-N
Species of MetaboliteComponentSourceComments
Actinoplanes (ncbitaxon:1865) - PubMed (3403368)
ChEBI Ontology
Outgoing Relation(s)
Actinoplanone D (CHEBI:222116) is a xanthones (CHEBI:51149)
IUPAC Name 
(13S,21R,22R,24R)-3,22,28-trihydroxy-21,24-dimethoxy-7-methyl-14,16,19-trioxa-6-azaheptacyclo[15.11.1.02,11.04,9.013,29.018,27.020,25]nonacosa-1(29),2(11),3,7,9,17,20(25),27-octaene-5,26-dione
Manual XrefsDatabases
78442979ChemSpider