input word = C00021265

Metabolite InformationStructural formula
Name Plagiochilin G
Formula C21H28O9
Mw 424.17333249
CAS RN 73039-18-6
C_ID C00021265 ,
InChIKey ZKMPQJZKRPJOCH-JROASMJXNA-N
InChICode InChI=1S/C21H28O9/c1-11(23)26-6-14-7-27-19(30-13(3)25)18-16(14)17-15(4-5-21(18)10-29-21)20(17,8-22)9-28-12(2)24/h7,15-19,22H,4-6,8-10H2,1-3H3/t15-,16+,17-,18-,19+,20+,21+/m0/s1
SMILES CC(=O)OCC1=CO[C@H](OC(C)=O)[C@@H]2[C@H]1[C@@H]1[C@H](CC[C@@]23CO3)[C@@]1(CO)COC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlagiochilaceaePlagiochila ovalifolia Ref.
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