input word = C00008404

Metabolite InformationStructural formula
Name Neolinderatone
Formula C35H44O4
Mw 528.32395989
CAS RN 123297-92-7
C_ID C00008404 ,
InChIKey CVKXAEQFTCAGJZ-UHFFFAOYNA-N
InChICode InChI=1S/C35H44O4/c1-19(2)24-14-12-21(5)16-26(24)30-33(37)31(27-17-22(6)13-15-25(27)20(3)4)35-32(34(30)38)28(36)18-29(39-35)23-10-8-7-9-11-23/h7-11,16-17,19-20,24-27,29,37-38H,12-15,18H2,1-6H3/t24-,25-,26+,27+,29+/m0/s1
SMILES c1(c(c2c(c(c1O)[C@H]1[C@@H](CCC(=C1)C)C(C)C)O[C@H](CC2=O)c1ccccc1)O)[C@@H]1C=C(CC[C@H]1C(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeLindera umbellata Ref.
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