| Name |
Uvaol 3-caffeate
(+)-Uvaol 3-caffeate |
| Formula |
C39H56O5 |
| Mw |
604.4127749 |
| CAS RN |
667465-76-1 |
| C_ID |
C00043996
, 
|
| InChIKey |
VAVKRHSGFFQRKW-JHJDDYLHNA-N |
| InChICode |
InChI=1S/C39H56O5/c1-24-14-19-39(23-40)21-20-37(6)27(34(39)25(24)2)10-12-31-36(5)17-16-32(35(3,4)30(36)15-18-38(31,37)7)44-33(43)13-9-26-8-11-28(41)29(42)22-26/h8-11,13,22,24-25,30-32,34,40-42H,12,14-21,23H2,1-7H3/b13-9+/t24-,25+,30+,31-,32+,34+,36+,37-,38-,39-/m1/s1 |
| SMILES |
C1[C@]2([C@H](C([C@H](C1)OC(=O)/C=C/c1ccc(c(c1)O)O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1(CC[C@@]1([C@H]2[C@H]([C@@H](CC1)C)C)CO)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Celastraceae | Maytenus ilicifolia  | Ref. |
|
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