input word = C00046030

Metabolite InformationStructural formula
Name Intrapetacin A
(-)-Intrapetacin A
Formula C30H38O8
Mw 526.25666819
CAS RN 343944-35-4
C_ID C00046030 ,
InChIKey NXJIENULLHZFNA-OYJJAWTRNA-N
InChICode InChI=1S/C30H38O8/c1-7-17(2)12-13-29(5)18(3)14-25(33)30-23(27(35-6)38-28(30)36-19(4)31)15-22(16-24(29)30)37-26(34)20-8-10-21(32)11-9-20/h7-11,15,18,22,24-25,27-28,32-33H,1-2,12-14,16H2,3-6H3/t18-,22-,24+,25+,27+,28-,29-,30+/m1/s1
SMILES C=CC(=C)CC[C@]1(C)[C@H](C)C[C@H](O)C23C(=C[C@@H](OC(=O)c4ccc(O)cc4)C[C@H]21)[C@@H](OC)O[C@H]3OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeChrysobalanaceaeLicania intrapetiolaris Ref.
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OrganismLicania intrapetiolaris
ReferenceOberlies,J.Nat.Prod.,64,(2001),497