CHEBI:207553 - 10Z-isocitreoviridinol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name 10Z-isocitreoviridinol
ChEBI ID CHEBI:207553
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H30O7
Net Charge 0
Average Mass 418.486
Monoisotopic Mass 418.19915
InChI InChI=1S/C23H30O7/c1-14-16(28-18(24)13-17(14)27-6)11-9-7-8-10-12-21(3)19(25)23(5)20(26)22(4,30-21)15(2)29-23/h7-13,15,19-20,25-26H,1-6H3/b8-7-,11-9+,12-10+/t15-,19-,20?,21+,22+,23+/m0/s1
InChIKey BHMIDMOHWXULQB-KRZGKEROSA-N
SMILES O=C1OC(=C(C)C(=C1)OC)/C=C/C=C\C=C\[C@]2(O[C@]3(C(O)[C@@]([C@H]2O)(O[C@H]3C)C)C)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing 10Z-isocitreoviridinol (CHEBI:207553) is a oxacycle (CHEBI:38104)
IUPAC Name
6-[(1E,3Z,5E)-6-[(1S,3R,4S,5R,7S)-4,8-dihydroxy-1,3,5,7-tetramethyl-2,6-dioxabicyclo[3.2.1]octan-3-yl]hexa-1,3,5-trienyl]-4-methoxy-5-methylpyran-2-one
Manual Xref Database
62344040 ChemSpider
View more database links