input word = C00054140

Metabolite InformationStructural formula
Name Armillarigin.
Formula C24H30O7
Mw 430.19915331
CAS RN 117240-47-8
C_ID C00054140
InChIKey NQAHWJIWYRYXFP-OCQSXXIKSA-N
InChICode InChI=1S/C24H30O7/c1-12-6-15(30-5)8-16(26)18(12)21(28)31-17-10-23(4)19-13(9-22(2,3)20(19)27)7-14(11-25)24(17,23)29/h6-8,11,13,17,19-20,26-27,29H,9-10H2,1-5H3/t13-,17-,19-,20-,23-,24+/m1/s1
SMILES OC1=C(C(O[C@@H]2C[C@@]3(C)[C@]2(O)C(C=O)=C[C@@]4([H])[C@]3([H])[C@@H](O)C(C)(C)C4)=O)C(C)=CC(OC)=C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeArmillaria mellea Ref.
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