input word = C00049366

Metabolite InformationStructural formula
Name Canophyllal
Formula C30H48O2
Mw 440.36543078
CAS RN 14440-40-5
C_ID C00049366 ,
InChIKey ONRNCDHSZVITNY-XFNXZCORNA-N
InChICode InChI=1S/C30H48O2/c1-20-21(32)8-9-22-26(20,4)11-10-23-27(22,5)13-14-29(7)24-18-25(2,3)12-16-30(24,19-31)17-15-28(23,29)6/h19-20,22-24H,8-18H2,1-7H3/t20-,22+,23-,24-,26+,27-,28+,29-,30+/m0/s1
SMILES C1[C@@H]2[C@](CCC1(C)C)(CC[C@]1([C@]2(CC[C@@]2([C@@H]1CC[C@]1([C@H]2CCC(=O)[C@@H]1C)C)C)C)C)C=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCelastraceaeTripterygium hypoglaucum Ref.
PlantaeHydrangeaceaePileostegia viburnoides var. glabrescens Ref.
PlantaeMyrtaceaeSyzygium formosanum Ref.
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OrganismTripterygium hypoglaucum
ReferenceLv, H. et al., Fitoterapia, 137, (2019), 104190.