input word = C00044791

Metabolite InformationStructural formula
Name Guidongnin B
(-)-Guidongnin B
Formula C20H26O5
Mw 346.17802394
CAS RN 596096-11-6
C_ID C00044791 ,
InChIKey KVVWTQICVCAEKK-DFTKNVAGNA-N
InChICode InChI=1S/C20H26O5/c1-11-12-4-5-13-19(10-25-17(23)20(13,8-12)15(11)21)7-3-6-18(2)9-24-16(22)14(18)19/h11-14H,3-10H2,1-2H3/t11-,12-,13+,14-,18+,19-,20+/m1/s1
SMILES C[C@H]1C(=O)[C@]23C[C@H]1CC[C@H]2[C@@]1(CCC[C@@]2(C)COC(=O)[C@H]21)COC3=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon rubescens var.lushiensis Ref.
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OrganismIsodon rubescens var.lushiensis
ReferenceHan,J.Nat.Prod.,66,(2003),1391