input word = C00045096

Metabolite InformationStructural formula
Name Subtrifloralactone K
(+)-Subtrifloralactone K
Formula C27H34O9
Mw 502.22028269
CAS RN 595548-85-9
C_ID C00045096 ,
InChIKey WGNSSHTUPLHGIN-SWHWGECMNA-N
InChICode InChI=1S/C27H34O9/c1-9-10(2)23(30)34-20(9)22-25(4,31)19-14-5-12-11-6-17-27(32)21(29)15(33-17)7-16(28)24(27,3)13(11)8-26(35-14,36-22)18(12)19/h9-15,17-20,22,31-32H,5-8H2,1-4H3/t9-,10-,11+,12+,13+,14+,15-,17+,18-,19+,20-,22+,24+,25-,26+,27+/m1/s1
SMILES C1[C@@H]2C(=O)[C@@]3([C@](C1=O)([C@@H]1[C@@H](C[C@@H]3O2)[C@H]2[C@H]3[C@]4(C1)O[C@H]([C@@]([C@H]3[C@H](C2)O4)(O)C)[C@@H]1OC(=O)[C@@H]([C@H]1C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeDeprea subtriflora Ref.
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OrganismDeprea subtriflora
ReferenceSu,J.Nat.Prod.,66,(2003),1089