| Name |
Calcicolin A |
| Formula |
C28H38O10 |
| Mw |
534.24649744 |
| CAS RN |
132185-53-6 |
| C_ID |
C00040905
, 
|
| InChIKey |
OSKSJKKACYXKDD-BZWSRRAKNA-N |
| InChICode |
InChI=1S/C28H38O10/c1-12-17-9-18(35-13(2)29)22-27(8)20(36-14(3)30)10-19(33)26(6,7)23(27)21(37-15(4)31)25(38-16(5)32)28(22,11-17)24(12)34/h17-23,25,33H,1,9-11H2,2-8H3/t17?,18-,19-,20-,21+,22-,23+,25-,27+,28-/m0/s1 |
| SMILES |
C1[C@@H](C([C@@H]2[C@]([C@H]1OC(=O)C)([C@H]1[C@@]3([C@H]([C@@H]2OC(=O)C)OC(=O)C)C[C@H](C[C@@H]1OC(=O)C)C(=C)C3=O)C)(C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Labiatae | Isodon calcicola | Ref. |
|
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