CHEBI:211939 - Nanangenine E

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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 Nanangenine E
ChEBI ID CHEBI:211939
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H36O5
Net Charge 0
Average Mass 392.536
Monoisotopic Mass 392.25627
InChI InChI=1S/C23H36O5/c1-5-6-7-8-9-11-18(24)28-17-14-16-15-27-20(25)23(16,26)22(4)13-10-12-21(2,3)19(17)22/h14,17,19,26H,5-13,15H2,1-4H3/t17-,19+,22+,23+/m1/s1
InChIKey FUVUCMYIQQWPPW-FUAMJQMHSA-N
SMILES O=C1OCC=2[C@@]1(O)[C@@]3([C@H](C(CCC3)(C)C)[C@@H](C2)OC(=O)CCCCCCC)C
Metabolite of Species Details
Aspergillus nanangensis (NCBI:txid2582783) See: PubMed
ChEBI Ontology
Outgoing Nanangenine E (CHEBI:211939) is a naphthofuran (CHEBI:39270)
IUPAC Name
[(5R,5aS,9aS,9bS)-9b-hydroxy-6,6,9a-trimethyl-1-oxo-3,5,5a,7,8,9-hexahydrobenzo[e][2]benzouran-5-yl] octanoate