input word = C00040863

Metabolite InformationStructural formula
Name Adenolin D
Formula C23H34O7
Mw 422.23045344
CAS RN 146436-19-3
C_ID C00040863 ,
InChIKey VVSBOWDVUWUVCK-YERRZCLHNA-N
InChICode InChI=1S/C23H34O7/c1-12(24)30-15-8-13-9-22(18(25)14(13)10-28-4)16(15)21-7-5-6-20(2,3)17(21)19(26)23(22,27)29-11-21/h13-17,19,26-27H,5-11H2,1-4H3/t13-,14+,15+,16-,17+,19-,21+,22-,23+/m0/s1
SMILES C1[C@]23[C@]4([C@H]([C@@H]5C(CCC[C@]5([C@@H]2[C@@H](C[C@@H]1[C@H](C3=O)COC)OC(=O)C)CO4)(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLamiaceaeRabdosia lihsienensis Ref.
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