CHEBI:227805 - Spiroterreusnoid C

ChEBI IDCHEBI:227805
ChEBI NameSpiroterreusnoid C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H40O7
Net Charge0
Average Mass488.621
Monoisotopic Mass488.27740
SMILESC=C1C[C@H]2[C@]3(C)CCC4(O[C@@H](C)[C@H](C)O4)C(C)(C)[C@H]3C(=O)[C@@H](O)[C@]2(C)[C@H]2C(=O)O[C@@H](C)C(=O)[C@]12C
InChIInChI=1S/C28H40O7/c1-13-12-17-25(7)10-11-28(34-14(2)15(3)35-28)24(5,6)19(25)18(29)22(31)27(17,9)20-23(32)33-16(4)21(30)26(13,20)8/h14-17,19-20,22,31H,1,10-12H2,2-9H3/t14-,15-,16-,17-,19+,20-,22+,25-,26+,27-/m0/s1
InChIKeyHOTGAJUCOXYBKH-FZBNHVRJSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (31203103)
ChEBI Ontology
Outgoing Relation(s)
Spiroterreusnoid C (CHEBI:227805) is a organic heterotricyclic compound (CHEBI:26979)
Spiroterreusnoid C (CHEBI:227805) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(2'S,4S,4'aR,4'bS,5S,5'S,6'aS,10'aS,10'bS,12'aS)-5'-hydroxy-2',4,4'b,5,7',7',10'a,12'a-octamethyl-12'-methylidenespiro[1,3-dioxolane-2,8'-5,6a,9,10,10b,11-hexahydro-4aH-naphtho[1,2-h]isochromene]-1',4',6'-trione