input word = C00000924

Metabolite InformationStructural formula
Name Demethylspheroidenone
Formula C40H56O2
Mw 568.42803103
CAS RN 70303-34-3
C_ID C00000924 ,
InChIKey YXTRGWPAUSOLAD-HMSUWCNJSA-N
InChICode InChI=1S/C40H56O2/c1-32(2)18-13-21-35(5)24-16-27-36(6)25-14-22-33(3)19-11-12-20-34(4)23-15-26-37(7)28-17-29-38(8)30-31-39(41)40(9,10)42/h11-12,14-15,17-20,22-26,28-31,42H,13,16,21,27H2,1-10H3/b12-11+,22-14+,23-15+,28-17+,31-30+,33-19+,34-20+,35-24+,36-25+,37-26+,38-29+
SMILES C(=C\C(=C\C=C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(\CC/C=C(/CCC=C(C)C)\C)/C)/C)\C)\C)\C)/C(=O)C(C)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--RhodobacteraceaeRhodobacter capsulatus Ref.
--RhodobacteraceaeRhodobacter sphaeroides Ref.
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OrganismRhodobacter capsulatus
ReferenceManwaring,FEBS Lett.,110,(1980),47