Name |
Brutieridin |
Formula |
C34H42O19 |
Mw |
754.23202916 |
CAS RN |
1162664-57-4 |
C_ID |
C00047768
,
|
InChIKey |
SHCWOSSXLGIQEQ-FVSHKKDHNA-N |
InChICode |
InChI=1S/C34H42O19/c1-13-26(41)28(43)30(45)32(49-13)53-31-29(44)27(42)22(12-48-24(40)11-34(2,46)10-23(38)39)52-33(31)50-15-7-17(36)25-18(37)9-20(51-21(25)8-15)14-4-5-19(47-3)16(35)6-14/h4-8,13,20,22,26-33,35-36,41-46H,9-12H2,1-3H3,(H,38,39)/t13-,20-,22+,26-,27-,28+,29-,30+,31+,32-,33+,34+/m0/s1 |
SMILES |
c1(cc(c2c(c1)O[C@@H](CC2=O)c1ccc(c(c1)O)OC)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)COC(=O)C[C@@](CC(=O)O)(O)C)O)O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Rutaceae | Citrus bergamia | Ref. |
|
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