CHEBI:206151 - (+)-neocitreoviridin

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 (+)-neocitreoviridin
ChEBI ID CHEBI:206151
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H30O6
Net Charge 0
Average Mass 402.487
Monoisotopic Mass 402.20424
InChI InChI=1S/C23H30O6/c1-15(14-22(4)21(25)23(5,26)17(3)29-22)11-9-7-8-10-12-18-16(2)19(27-6)13-20(24)28-18/h7-14,17,21,25-26H,1-6H3/b8-7?,11-9?,12-10?,15-14-/t17-,21+,22+,23+/m1/s1
InChIKey JLSVDPQAIKFBTO-AIHYNYPSSA-N
SMILES O=C1OC(=C(C)C(=C1)OC)C=CC=CC=C/C(=C\[C@@]2(O[C@H](C)[C@@]([C@H]2O)(O)C)C)/C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing (+)-neocitreoviridin (CHEBI:206151) is a pyranone (CHEBI:37963)
IUPAC Name
6-[(7Z)-8-[(2S,3R,4R,5R)-3,4-dihydroxy-2,4,5-trimethyloxolan-2-yl]-7-methylocta-1,3,5,7-tetraenyl]-4-methoxy-5-methylpyran-2-one