input word = C00052999

Metabolite InformationStructural formula
Name Daldinin B2
Formula C29H46O5
Mw 474.33452458
CAS RN 162559-04-8
C_ID C00052999
InChIKey KMXVDEFOJFQJAD-UHFFFAOYSA-N
InChICode InChI=1S/C29H46O5/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/h21-23H,4-20H2,1-3H3
SMILES CC1OC=C(C(C2(OC(CCCCCCCCCCCCCCCCC)=O)C)=O)C(C1)=CC2=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiXylariaceaeDaldinia concentrica Ref.
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