input word = C00033993

Metabolite InformationStructural formula
Name Kermadecin C
Formula C31H40O5
Mw 492.28757439
CAS RN 1005005-06-0
C_ID C00033993 ,
InChIKey LNALKEIQYKOVHK-UHFFFAOYSA-N
InChICode InChI=1S/C31H40O5/c1-31(2)18-17-23-28(34)26-22(29(35)30(23)36-31)16-14-12-10-8-6-4-3-5-7-9-11-13-15-21-19-24(32)27(26)25(33)20-21/h17-20,32-33H,3-16H2,1-2H3
SMILES c1c2cc(c(c1O)C1=C(CCCCCCCCCCCCCC2)C(=O)C2=C(C1=O)C=CC(O2)(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeProteaceaeKermadecia elliptica Ref.
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