input word = C00049651

Metabolite InformationStructural formula
Name Lungshengenin E
(-)-Lungshengenin E
Formula C28H38O9
Mw 518.25158281
CAS RN 240811-08-9
C_ID C00049651 ,
InChIKey CSSFHCNGJKKNKZ-HTKRUZIWNA-N
InChICode InChI=1S/C28H38O9/c1-13-18-9-20(34-14(2)29)23-27(8)12-21(35-15(3)30)25(37-17(5)32)26(6,7)22(27)19(33)11-28(23,10-18)24(13)36-16(4)31/h18,20-25H,1,9-12H2,2-8H3/t18-,20+,21+,22-,23+,24-,25+,27-,28+/m1/s1
SMILES [C@H]1([C@@H]2[C@]3(C[C@@H](C1)C(=C)[C@H]3OC(=O)C)CC(=O)[C@H]1[C@]2(C[C@@H]([C@@H](C1(C)C)OC(=O)C)OC(=O)C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon lungshengensis Ref.
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OrganismIsodon lungshengensis
ReferenceJiang,J.Nat.Prod.,62,(1999),941