input word = C00038715

Metabolite InformationStructural formula
Name Cedrusin tetraacetate
Formula C27H30O10
Mw 514.18389718
CAS RN 98819-79-5
C_ID C00038715 ,
InChIKey NBKXMCXVNUKNJF-UHFFFAOYNA-N
InChICode InChI=1S/C27H30O10/c1-15(28)33-10-6-7-19-11-21-22(14-34-16(2)29)26(37-27(21)25(12-19)36-18(4)31)20-8-9-23(35-17(3)30)24(13-20)32-5/h8-9,11-13,22,26H,6-7,10,14H2,1-5H3/t22-,26+/m0/s1
SMILES c12c([C@@H]([C@H](O1)c1ccc(c(c1)OC)OC(=O)C)COC(=O)C)cc(cc2OC(=O)C)CCCOC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCupressaceaeChamaecyparis formosensis Ref.
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