input word = C00052992

Metabolite InformationStructural formula
Name Daldinin A2
Formula C29H44O5
Mw 472.31887452
CAS RN 162558-82-9
C_ID C00052992
InChIKey YEGFGOHUKJZOPE-GDLZYMKVSA-N
InChICode InChI=1S/C29H44O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(31)34-29(3)26(30)21-24-20-23(2)33-22-25(24)28(29)32/h20-22H,4-19H2,1-3H3/t29-/m1/s1
SMILES CCCCCCCCCCCCCCCCCC(=O)O[C@]1(C)C(=O)C=C2C=C(C)OC=C2C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiXylariaceaeDaldinia concentrica Ref.
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OrganismDaldinia concentrica
ReferenceOsmanova, N. et al. Phytochem. Rev., 9, (2010), 315-342.