CHEBI:200323 - Militarinone 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 Militarinone E
ChEBI ID CHEBI:200323
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C26H35NO5
Net Charge 0
Average Mass 441.568
Monoisotopic Mass 441.25152
InChI InChI=1S/C26H35NO5/c1-5-17(2)14-19(4)15-18(3)8-6-7-9-23(29)24-25(30)22(16-27(32)26(24)31)20-10-12-21(28)13-11-20/h6-10,15-17,19,21,28,30,32H,5,11-14H2,1-4H3/b8-6+,9-7+,18-15+/t17?,19?,21-/m1/s1
InChIKey BFJKFLDLQKCOHR-KPIYIFLYSA-N
SMILES O=C1N(O)C=C(C2=CC[C@@H](O)CC2)C(=C1C(=O)/C=C/C=C/C(=C/C(CC(CC)C)C)/C)O
Metabolite of Species Details
Cordyceps farinosa (NCBI:txid89141) See: PubMed
ChEBI Ontology
Outgoing Militarinone E (CHEBI:200323) is a monoterpenoid (CHEBI:25409)
IUPAC Name
1,4-dihydroxy-5-[(4S)-4-hydroxycyclohexen-1-yl]-3-[(2E,4E,6E)-6,8,10-trimethyldodeca-2,4,6-trienoyl]pyridin-2-one
Manual Xref Database
28288464 ChemSpider
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