| Name |
Areptin B |
| Formula |
C29H40O10 |
| Mw |
548.2621475 |
| CAS RN |
220997-81-9 |
| C_ID |
C00040877
, 
|
| InChIKey |
VHMXRHYBQSWLTN-AQIHBAAYNA-N |
| InChICode |
InChI=1S/C29H40O10/c1-7-15(2)25(33)38-20-12-21(32)29(14-36-29)28(13-35-17(4)30)23(37-18(5)31)10-16(3)27(6,24(20)28)22-11-19-8-9-34-26(19)39-22/h7-9,16,19-24,26,32H,10-14H2,1-6H3/b15-7+/t16-,19-,20-,21+,22+,23+,24-,26-,27-,28-,29-/m1/s1 |
| SMILES |
[C@H]1(C[C@@H]([C@@]2([C@@H]([C@]1([C@@H]1C[C@@H]3[C@@H](O1)OC=C3)C)[C@@H](C[C@@H]([C@]12OC1)O)OC(=O)/C(=C/C)/C)COC(=O)C)OC(=O)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Ajuga reptans  | Ref. |
|
|
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