input word = C00021691

Metabolite InformationStructural formula
Name Decumbeside A
Formula C24H28O11
Mw 492.16316174
CAS RN 111394-29-7
C_ID C00021691 ,
InChIKey DUSNEDXMOOGSOE-IAGRDSBVNA-N
InChICode InChI=1S/C24H28O11/c1-23-15(35-23)10-24(30)8-9-31-22(20(23)24)34-21-19(18(29)17(28)14(11-25)32-21)33-16(27)7-4-12-2-5-13(26)6-3-12/h2-9,14-15,17-22,25-26,28-30H,10-11H2,1H3/b7-4-/t14-,15+,17-,18+,19-,20-,21+,22+,23+,24+/m1/s1
SMILES [C@]12([C@H]([C@@H](OC=C1)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)OC(=O)/C=C\c1ccc(cc1)O)[C@@]1([C@H](C2)O1)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeAjuga decumbens Ref.
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OrganismAjuga decumbens
ReferenceTakeda,Phytochem.,26,(1987),2303