input word = C00041391

Metabolite InformationStructural formula
Name Briarellin R
Formula C24H36O5
Mw 404.25627426
CAS RN 917979-40-9
C_ID C00041391 ,
InChIKey WFKXCGWVYJNIRE-NTEUORMPNA-N
InChICode InChI=1S/C24H36O5/c1-6-8-18(25)28-23(4)12-10-16-15(3)22(26)29-24(5)11-7-9-14(2)13-17-20(23)19(16)21(24)27-17/h9,15-17,19-21H,6-8,10-13H2,1-5H3/b14-9+/t15-,16-,17-,19+,20+,21-,23-,24-/m1/s1
SMILES C\1(=C/CC[C@]2(OC(=O)[C@@H]([C@@H]3[C@@H]4[C@H]2O[C@@H]([C@@H]4[C@](CC3)(C)OC(=O)CCC)C1)C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum polyanthes Ref.
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OrganismBriareum polyanthes
ReferenceOspina,J.Nat.Prod.,69,(2006),1721