input word = C00038361

Metabolite InformationStructural formula
Name Acutissimatriterpene C
(-)-Acutissimatriterpene C
Formula C40H50O8
Mw 658.35056857
CAS RN 1005390-43-1
C_ID C00038361 ,
InChIKey FMFUJZHVPRHFHL-TXBNHQOCNA-N
InChICode InChI=1S/C40H50O8/c1-34(43-5)18-40(47-20-34)17-25(33(42)48-40)26-9-13-39-19-38(26,39)12-10-30-35(2)11-8-24-15-28(23-6-7-27-29(14-23)46-22-45-27)44-21-36(24,3)31(35)16-32(41)37(30,39)4/h6-8,14,17,26,28,30-32,41H,9-13,15-16,18-22H2,1-5H3/t26-,28-,30+,31+,32+,34+,35+,36-,37-,38+,39+,40-/m0/s1
SMILES CO[C@@]1(C)CO[C@]2(C=C([C@@H]3CC[C@]45C[C@]34CC[C@@H]3[C@@]4(C)CC=C6C[C@@H](c7ccc8c(c7)OCO8)OC[C@]6(C)[C@@H]4C[C@@H](O)[C@]35C)C(=O)O2)C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaePhyllanthus acutissima Ref.
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