input word = C00057761

Metabolite InformationStructural formula
Name Strobilol I
Formula C25H40O6
Mw 436.28248901
CAS RN 1078135-01-9
C_ID C00057761
InChIKey AZCCBOGMNKOZLP-MTMBJODSSA-N
InChICode InChI=1S/C25H40O6/c1-5-6-7-8-9-10-11-12-20(26)30-22-21-18(13-19-23(22,4)31-19)16(2)14-24(27)25(21,28)17(3)15-29-24/h16,18-19,21-22,27-28H,3,5-15H2,1-2,4H3/t16-,18+,19+,21+,22-,23+,24+,25+/m1/s1
SMILES C=C1CO[C@@]2(O)C[C@@H](C)[C@@H]3C[C@@H]4O[C@]4(C)[C@H](OC(=O)CCCCCCCCC)[C@H]3[C@@]12O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiPhysalacriaceaeStrobilurus ohshimae Ref.
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OrganismStrobilurus ohshimae
ReferenceHiramatsu, F. et al., Phytochemistry, 2007, 68, 1267-1271 (Strobilols A-D)