input word = C00020926

Metabolite InformationStructural formula
Name Lemmonin D
Formula C23H34O9
Mw 454.22028269
CAS RN 128529-98-6
C_ID C00020926 ,
InChIKey ACTMGSKCMXZHRH-TXDFJEFXNA-N
InChICode InChI=1S/C23H34O9/c1-10-7-16-14(11(2)21(28)30-16)8-15-13(10)5-6-23(15,4)32-22-20(27)19(26)18(25)17(31-22)9-29-12(3)24/h8,10-11,13-14,16-20,22,25-27H,5-7,9H2,1-4H3/t10-,11+,13+,14-,16-,17-,18-,19+,20-,22+,23-/m1/s1
SMILES CC(=O)OCC1O[C@@H](O[C@]2(C)CC[C@@H]3C2=CC2[C@H](C)C(=O)O[C@@H]2C[C@H]3C)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHymenoxys lemmonii Ref.
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OrganismHymenoxys lemmonii
ReferenceGao,Phytochem.,29,(1990),1601