input word = C00038400

Metabolite InformationStructural formula
Name Alboatisin C
(-)-Alboatisin C
Formula C20H30O4
Mw 334.21440945
CAS RN 943232-50-6
C_ID C00038400 ,
InChIKey WHNRXVKFGPGHAF-BMDXWAJNNA-N
InChICode InChI=1S/C20H30O4/c1-11-12-7-15-19(3)6-4-5-18(2,10-21)14(19)8-16(23)20(15,17(11)24)9-13(12)22/h12-16,21-23H,1,4-10H2,2-3H3/t12-,13+,14+,15-,16+,18+,19+,20+/m0/s1
SMILES C=C1C(=O)[C@]23C[C@@H](O)[C@H]1C[C@H]2[C@]1(C)CCC[C@](C)(CO)[C@H]1C[C@H]3O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon albopilosus Ref.
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