input word = C00020979

Metabolite InformationStructural formula
Name Mexicanin F
Formula C28H32O6
Mw 464.21988875
CAS RN 97452-14-7
C_ID C00020979 ,
InChIKey LVTHSNDCPQIIGB-UGKBQFNJNA-N
InChICode InChI=1S/C28H32O6/c1-12-6-22-18(8-16-15(12)4-5-20(16)29)28(26(32)34-22)11-27-10-17-14(3)25(31)33-21(17)7-13(2)24(27)19(28)9-23(27)30/h4-5,12-13,15-19,21-22,24H,3,6-11H2,1-2H3/t12-,13-,15-,16-,17-,18+,19-,21-,22-,24+,27+,28-/m1/s1
SMILES C=C1C(=O)OC2C[C@@H](C)C3C4CC(=O)C3(CC12)CC41C(=O)O[C@@H]2C[C@@H](C)[C@@H]3C=CC(=O)[C@@H]3C[C@@H]21
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelenium mexicanum Ref.
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