| Name |
Orthosiphol U
(-)-Orthosiphol U |
| Formula |
C33H42O11 |
| Mw |
614.27271219 |
| CAS RN |
502914-91-2 |
| C_ID |
C00044978
, 
|
| InChIKey |
VXLLVGCAWRWNCI-AJLRIZRZNA-N |
| InChICode |
InChI=1S/C33H42O11/c1-9-31(7)16-21(37)25-32(8)22(15-23(41-17(2)34)33(25,40)29(31)39)30(5,6)26(43-19(4)36)24(42-18(3)35)27(32)44-28(38)20-13-11-10-12-14-20/h9-14,21-27,37,40H,1,15-16H2,2-8H3/t21-,22+,23-,24+,25-,26-,27+,31+,32+,33+/m1/s1 |
| SMILES |
[C@@H]1([C@H](C([C@H]2[C@]([C@H]1OC(=O)c1ccccc1)([C@@H]1[C@@]([C@@H](C2)OC(=O)C)(C(=O)[C@](C[C@H]1O)(C=C)C)O)C)(C)C)OC(=O)C)OC(=O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Orthosiphon stamineus  | Ref. |
|
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