input word = C00049872

Metabolite InformationStructural formula
Name Excavatolide F
(-)-Excavatolide F
Formula C30H40O11
Mw 576.25706212
CAS RN 221664-88-6
C_ID C00049872 ,
InChIKey GQDAKDHRSOAMMK-IJGWGXFONA-N
InChICode InChI=1S/C30H40O11/c1-9-10-24(34)39-20-14-22(37-18(5)32)28(7)21(36-17(4)31)12-11-15(2)13-23-30(29(8,41-30)27(35)40-23)26(38-19(6)33)25(28)16(20)3/h11-13,16,20-23,25-26H,9-10,14H2,1-8H3/b12-11+,15-13-/t16-,20-,21-,22-,23-,25+,26+,28-,29-,30-/m0/s1
SMILES [C@@H]1([C@@]23[C@H](/C=C(\C=C\[C@@H]([C@@]4([C@@H]1[C@H]([C@H](C[C@@H]4OC(=O)C)OC(=O)CCC)C)C)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