input word = C00033057

Metabolite InformationStructural formula
Name Isoadiantone
(+)-Isoadiantone
Formula C29H28O
Mw 392.21401552
CAS RN 54352-47-5
C_ID C00033057 ,
InChIKey DCBAVUVLEYSTPU-QYMFGHKDNA-N
InChICode InChI=1S/C29H48O/c1-19(30)20-11-16-26(4)21(20)12-17-28(6)23(26)9-10-24-27(5)15-8-14-25(2,3)22(27)13-18-29(24,28)7/h20-24H,8-18H2,1-7H3/t20-,21-,22-,23+,24+,26-,27-,28+,29+/m0/s1
SMILES CC(=O)[C@@H]1CC[C@]2(C)[C@H]3CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeAlbizia odoratissima Ref.
PlantaePteridaceaeAdiantum caudatum Ref.
PlantaePteridaceaeAdiantum pedatum Ref.
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OrganismAdiantum pedatum
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979)