input word = C00047548

Metabolite InformationStructural formula
Name Pseurata B
Formula C20H30O5
Mw 350.20932407
CAS RN 130396-69-9
C_ID C00047548 ,
InChIKey BRNLPJIEDLXFLS-ACCZPIQINA-N
InChICode InChI=1S/C20H30O5/c1-9-15-10(21)7-12-19(4)6-5-13(22)18(2,3)11(19)8-14(23)20(12,16(9)24)17(15)25/h10-15,17,21-23,25H,1,5-8H2,2-4H3/t10-,11+,12-,13+,14+,15+,17-,19+,20-/m0/s1
SMILES C=C1C(=O)[C@]23C(O)[C@H]1[C@@H](O)C[C@H]2[C@]1(C)CC[C@@H](O)C(C)(C)[C@H]1C[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon pharicus Ref.
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