input word = C00022230

Metabolite InformationStructural formula
Name Phlogantholide A
Formula C20H30O4
Mw 334.21440945
CAS RN 81727-18-6
C_ID C00022230 ,
InChIKey KYVZZZCAIHBFLU-GDRFJZHQNA-N
InChICode InChI=1S/C20H30O4/c1-13-4-7-17-19(2,12-21)10-15(22)11-20(17,3)16(13)6-5-14-8-9-24-18(14)23/h8,15-17,21-22H,1,4-7,9-12H2,2-3H3/t15-,16-,17+,19+,20+/m1/s1
SMILES [C@H]1(C[C@@]([C@H]2[C@@](C1)([C@@H](C(=C)CC2)CCC1=CCOC1=O)C)(C)CO)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaePhlogacanthus thyrsiflorus Ref.
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