input word = C00046276

Metabolite InformationStructural formula
Name Papuaforin D
(+)-Papuaforin D
Formula C32H46O4
Mw 494.33960996
CAS RN 350028-01-2
C_ID C00046276 ,
InChIKey RGSVQMYTCISWQL-KBJJQJTLNA-N
InChICode InChI=1S/C32H46O4/c1-11-22(6)25(33)32-26(34)24-16-18-29(7,8)36-27(24)30(9,28(32)35)19-23(15-14-21(4)5)31(32,10)17-12-13-20(2)3/h13-14,16,18,22-23H,11-12,15,17,19H2,1-10H3/t22-,23-,30+,31+,32-/m1/s1
SMILES CCC(C)C(=O)[C@]12C(=O)C3=C(OC(C)(C)C=C3)[C@](C)(C[C@@H](CC=C(C)C)[C@]1(C)CCC=C(C)C)C2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeHypericaceaeHypericum papuanum Ref.
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