input word = C00041989

Metabolite InformationStructural formula
Name (-)-Stypoldione
Formula C27H38O4
Mw 426.2770097
CAS RN 71103-05-4
C_ID C00041989 ,
InChIKey LLWMPGSQZXZZAE-FUPKUGRTNA-N
InChICode InChI=1S/C27H38O4/c1-15-13-18(28)22(30)17-14-27(31-23(15)17)16(2)7-8-20-25(5)11-10-21(29)24(3,4)19(25)9-12-26(20,27)6/h13,16,19-21,29H,7-12,14H2,1-6H3/t16-,19-,20+,21-,25-,26+,27-/m0/s1
SMILES CC1=CC(=O)C(=O)C2=C1O[C@@]1(C2)[C@@H](C)CC[C@@H]2[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]21C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ChromalveolataDictyotaceaeStypopodium flabelliforme Ref.
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OrganismStypopodium flabelliforme
ReferenceSabry,J.Nat.Prod.,68,(2005),1022