input word = C00047547

Metabolite InformationStructural formula
Name Pseurata A
Formula C20H30O4
Mw 334.21440945
CAS RN 113105-70-7
C_ID C00047547 ,
InChIKey BAXVJERFBZODKZ-XZQSDYFJNA-N
InChICode InChI=1S/C20H30O4/c1-10-11-5-6-12-19(4)8-7-14(21)18(2,3)13(19)9-15(22)20(12,16(10)23)17(11)24/h11-15,17,21-22,24H,1,5-9H2,2-4H3/t11-,12-,13+,14+,15+,17+,19-,20-/m0/s1
SMILES [C@@H]1([C@@]23[C@@H](CC[C@H]1C(=C)C3=O)[C@]1([C@H](C[C@H]2O)C([C@@H](CC1)O)(C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon pharicus Ref.
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