input word = C00046277

Metabolite InformationStructural formula
Name Papuaforin E
(+)-Papuaforin E
Formula C31H44O4
Mw 480.32395989
CAS RN 350028-02-3
C_ID C00046277 ,
InChIKey FJWIFMCUHVVWDK-QDBXGSLNNA-N
InChICode InChI=1S/C31H44O4/c1-19(2)12-11-16-30(10)22(14-13-20(3)4)18-29(9)26-23(15-17-28(7,8)35-26)25(33)31(30,27(29)34)24(32)21(5)6/h12-13,15,17,21-22H,11,14,16,18H2,1-10H3/t22-,29+,30+,31-/m1/s1
SMILES [C@@H]1([C@]([C@@]2(C(=O)C3=C(OC(C=C3)(C)C)[C@@](C2=O)(C1)C)C(=O)C(C)C)(C)CCC=C(C)C)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum papuanum Ref.
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