input word = C00049870

Metabolite InformationStructural formula
Name Excavatolide D
(+)-Excavatolide D
Formula C26H36O11
Mw 524.22576199
CAS RN 205581-12-0
C_ID C00049870 ,
InChIKey CFPXJIULHDSQCG-LWGBRWBBNA-N
InChICode InChI=1S/C26H36O11/c1-11-8-17(33-13(3)27)21(31)24(6)18(34-14(4)28)10-16(30)12(2)20(24)22(35-15(5)29)26-19(9-11)36-23(32)25(26,7)37-26/h9,12,16-22,30-31H,8,10H2,1-7H3/b11-9-/t12-,16-,17-,18-,19-,20+,21-,22-,24-,25-,26-/m0/s1
SMILES [C@H]1([C@@]23[C@H](/C=C(\C[C@@H]([C@@H]([C@@]4([C@@H]1[C@H]([C@H](C[C@@H]4OC(=O)C)O)C)C)O)OC(=O)C)/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
ReferenceSheu,J.Nat.Prod.,61,(1998),602