input word = C00050832

Metabolite InformationStructural formula
Name Inflexarabdonin G
(-)-Inflexarabdonin G
Formula C24H34O6
Mw 418.23553882
CAS RN 130756-07-9
C_ID C00050832
InChIKey BWMMHCUVAKMATG-HRQLWMONNA-N
InChICode InChI=1S/C24H34O6/c1-12-15-9-16(29-13(2)25)20-23(6)17(7-8-24(20,11-15)21(12)28)22(4,5)19(10-18(23)27)30-14(3)26/h15-20,27H,1,7-11H2,2-6H3/t15-,16+,17-,18+,19+,20+,23+,24-/m1/s1
SMILES C=C1C(=O)[C@@]23CC[C@@H]4C(C)(C)[C@@H](OC(C)=O)C[C@H](O)[C@@]4(C)[C@@H]2[C@@H](OC(C)=O)C[C@@H]1C3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon inflexa Ref.
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OrganismIsodon inflexa
ReferenceSun, et al., Diterpenoids from Isodon Species, Science Press, Beijing, (2001)