input word = C00042303

Metabolite InformationStructural formula
Name Briaranolide A
(+)-Briaranolide A
Formula C30H38O13
Mw 606.2312413
CAS RN 866087-85-6
C_ID C00042303 ,
InChIKey VVIOGGVBTYJURI-MPRKZAKQNA-N
InChICode InChI=1S/C30H38O13/c1-13-10-11-20(37-15(3)31)28(8)22(13)25(40-18(6)34)30-21(42-27(36)29(30,9)43-30)12-14(2)23(38-16(4)32)24(39-17(5)33)26(28)41-19(7)35/h10,12,20-26H,11H2,1-9H3/b14-12-/t20-,21-,22+,23+,24-,25-,26-,28-,29-,30-/m0/s1
SMILES CC(=O)O[C@H]1[C@H](OC(C)=O)/C(C)=C[C@@H]2OC(=O)[C@]3(C)O[C@]23[C@@H](OC(C)=O)[C@H]2C(C)=CC[C@H](OC(C)=O)[C@]2(C)[C@H]1OC(C)=O
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