input word = C00042305

Metabolite InformationStructural formula
Name Briaranolide C
(+)-Briaranolide C
Formula C34H46O13
Mw 662.29384156
CAS RN 866087-87-8
C_ID C00042305 ,
InChIKey GBCBINOVRJNUFM-TZHPPBEKNA-N
InChICode InChI=1S/C34H46O13/c1-10-12-24(38)45-27-18(4)16-23-34(33(9,47-34)31(40)44-23)29(42-20(6)36)26-17(3)14-15-22(41-19(5)35)32(26,8)30(43-21(7)37)28(27)46-25(39)13-11-2/h14,16,22-23,26-30H,10-13,15H2,1-9H3/b18-16-/t22-,23-,26+,27+,28-,29-,30-,32-,33-,34-/m0/s1
SMILES C1=C([C@H]2[C@]([C@H](C1)OC(=O)C)([C@H]([C@H]([C@@H](/C(=C\[C@H]1[C@]3([C@H]2OC(=O)C)[C@](C(=O)O1)(O3)C)/C)OC(=O)CCC)OC(=O)CCC)OC(=O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum sp. Ref.
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OrganismBriareum sp.
ReferenceHoshino,J.Nat.Prod.,68,(2005),1328