input word = C00039980

Metabolite InformationStructural formula
Name Petroformynic acid C
(+)-Petroformynic acid C
Formula C47H70O4
Mw 698.52741072
CAS RN 1000701-84-7
C_ID C00039980 ,
InChIKey BQLNMCQNOASKKE-CLBVXMGVNA-N
InChICode InChI=1S/C47H70O4/c1-2-45(48)41-37-33-29-27-28-31-35-39-43-46(49)42-38-34-30-25-23-21-19-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20-22-24-26-32-36-40-44-47(50)51/h1,7,9,19,21,30,34,37,41,45-46,48-49H,3-6,8,10-18,20,22-29,31-33,35-36H2,(H,50,51)/b9-7-,21-19-,34-30+,41-37+/t45-,46-/m1/s1
SMILES C(
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Pertrosia sp. Ref.
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OrganismPertrosia sp.
ReferenceOkamoto,J.Nat.Prod.,70,(2007),1816