| Name |
Orthosiphol O
(-)-Orthosiphol O |
| Formula |
C38H44O11 |
| Mw |
676.28836225 |
| CAS RN |
451475-23-3 |
| C_ID |
C00044975
, 
|
| InChIKey |
MTXOFPKHBDQARM-GKIRPWIQNA-N |
| InChICode |
InChI=1S/C38H44O11/c1-8-36(6)20-25(41)29-37(7)26(19-27(46-21(2)39)38(29,45)34(36)44)35(4,5)30(48-32(42)23-15-11-9-12-16-23)28(47-22(3)40)31(37)49-33(43)24-17-13-10-14-18-24/h8-18,25-31,41,45H,1,19-20H2,2-7H3/t25-,26?,27-,28+,29-,30-,31+,36+,37+,38+/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)c1ccccc1)OC(=O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Orthosiphon stamineus  | Ref. |
|
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