input word = C00037716

Metabolite InformationStructural formula
Name Rabdosin A
(-)-Rabdosin A
Formula C21H28O6
Mw 376.18858863
CAS RN 84304-91-6
C_ID C00037716 ,
InChIKey ANNDQWYMQQILCQ-FXCBKCIONA-N
InChICode InChI=1S/C21H28O6/c1-10-11-7-12(22)14-20(8-11,16(10)23)18(24)27-13-5-6-19(2,3)15-17(25-4)26-9-21(13,14)15/h11-15,17,22H,1,5-9H2,2-4H3/t11-,12+,13+,14-,15-,17-,20+,21+/m1/s1
SMILES [C@@H]1(C[C@H]2C(=C)C(=O)[C@@]3([C@@H]1[C@]14[C@@H](OC3=O)CCC([C@H]1[C@@H](OC4)OC)(C)C)C2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon japonica Ref.
PlantaeLamiaceaeRabdosia japonica Ref.
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