input word = C00042321

Metabolite InformationStructural formula
Name Briarlide Q
(-)-Briarlide Q
Formula C34H48O12
Mw 648.314577
CAS RN 845641-27-2
C_ID C00042321 ,
InChIKey MXIGBACWPUOFKT-ZAABDEKMNA-N
InChICode InChI=1S/C34H48O12/c1-9-10-11-12-13-14-25(38)45-27-19(3)17-24-34(33(8,46-34)31(40)44-24)30(43-22(6)37)26-18(2)15-16-23(41-20(4)35)32(26,7)29(39)28(27)42-21(5)36/h15,17,23-24,26-30,39H,9-14,16H2,1-8H3/b19-17-/t23-,24-,26+,27-,28+,29-,30-,32-,33-,34-/m0/s1
SMILES [C@H]1([C@@]23[C@H](/C=C(\[C@@H]([C@H]([C@@H]([C@@]4([C@@H]1C(=CC[C@@H]4OC(=O)C)C)C)O)OC(=O)C)OC(=O)CCCCCCC)/C)OC(=O)[C@@]2(O3)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum sp. Ref.
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OrganismBriareum sp.
ReferenceIwagawa,J.Nat.Prod.,68,(2005),31