input word = C00048636

Metabolite InformationStructural formula
Name Briaexcavatin R
(+)-Briaexcavatin R
Formula C26H36O11
Mw 524.22576199
CAS RN 1124328-09-1
C_ID C00048636 ,
InChIKey ISMNWDGRWZSBGL-ZVOALFECNA-N
InChICode InChI=1S/C26H36O11/c1-11-8-20-26(25(7,37-26)23(32)36-20)22(35-15(5)29)21-12(2)17(31)10-19(34-14(4)28)24(21,6)18(9-16(11)30)33-13(3)27/h8,12,16-22,30-31H,9-10H2,1-7H3/b11-8-/t12-,16+,17-,18-,19-,20-,21+,22-,24-,25-,26-/m0/s1
SMILES [C@H]1([C@@]23[C@H](/C=C(\[C@@H](C[C@@H]([C@@]4([C@@H]1[C@H]([C@H](C[C@@H]4OC(=O)C)O)C)C)OC(=O)C)O)/C)OC(=O)[C@@]2(O3)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum excavatum Ref.
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OrganismBriareum excavatum
ReferenceBlunt,Nat.Prod.Rep.,27,(2010),165