input word = C00051124

Metabolite InformationStructural formula
Name Kamebakaurinin
Formula C20H30O5
Mw 350.20932407
CAS RN 74144-54-0
C_ID C00051124
InChIKey BCIUAQVTZYTSHZ-INSFWQGUNA-N
InChICode InChI=1S/C20H30O5/c1-10-11-7-12(22)15-19(9-21)6-4-5-18(2,3)13(19)8-14(23)20(15,16(10)24)17(11)25/h11-15,17,21-23,25H,1,4-9H2,2-3H3/t11-,12-,13+,14+,15-,17?,19-,20+/m0/s1
SMILES C=C1C(=O)[C@]23C(O)[C@H]1C[C@H](O)[C@H]2[C@]1(CO)CCCC(C)(C)[C@H]1C[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon kameba Ref.
PlantaeLabiataeIsodon umbrosa var.latifolia Ref.
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