CHEBI:209767 - Monapinone C

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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 Monapinone C
ChEBI ID CHEBI:209767
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C23H30O9
Net Charge 0
Average Mass 450.484
Monoisotopic Mass 450.18898
InChI InChI=1S/C23H30O9/c1-11(24)3-14(25)7-15(26)8-16(27)9-18-6-13-4-12-5-17(31-2)10-19(28)20(12)22(29)21(13)23(30)32-18/h4-5,10-11,14-16,18,24-29H,3,6-9H2,1-2H3/t11?,14?,15?,16?,18-/m0/s1
InChIKey CSZSHBYJZUVYDB-VKFUNQEBSA-N
SMILES O=C1O[C@@H](CC=2C1=C(O)C3=C(O)C=C(OC)C=C3C2)CC(O)CC(O)CC(O)CC(O)C
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing Monapinone C (CHEBI:209767) is a organic heterotricyclic compound (CHEBI:26979)
Monapinone C (CHEBI:209767) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(3S)-9,10-dihydroxy-7-methoxy-3-(2,4,6,8-tetrahydroxynonyl)-3,4-dihydrobenzo[g]isochromen-1-one
Manual Xref Database
28288897 ChemSpider
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