input word = C00049648

Metabolite InformationStructural formula
Name Lungshengenin B
(-)-Lungshengenin B
Formula C28H38O10
Mw 534.24649744
CAS RN 202344-42-1
C_ID C00049648 ,
InChIKey CXQSBKKFTCJQCK-KEZLPLANNA-N
InChICode InChI=1S/C28H38O10/c1-12-17-9-19(35-13(2)29)22-27(8)21(18(33)11-28(22,10-17)24(12)37-15(4)31)26(6,7)25(38-16(5)32)20(23(27)34)36-14(3)30/h17,19-25,34H,1,9-11H2,2-8H3/t17-,19+,20+,21-,22+,23+,24-,25+,27-,28+/m1/s1
SMILES C=C1[C@@H]2C[C@H](OC(C)=O)[C@@H]3[C@@](CC(=O)[C@@H]4C(C)(C)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](O)[C@]43C)(C2)[C@@H]1OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon lungshengensis Ref.
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