| Name |
Isoesculeogenin A |
| Formula |
C27H45NO4 |
| Mw |
447.33485893 |
| CAS RN |
854381-39-8 |
| C_ID |
C00031901
, 
|
| InChIKey |
FBKQAVWTYDQPAB-NUXUQDNGNA-N |
| InChICode |
InChI=1S/C27H45NO4/c1-15-24-22(32-27(15)23(31)10-16(14-29)13-28-27)12-21-19-5-4-17-11-18(30)6-8-25(17,2)20(19)7-9-26(21,24)3/h15-24,28-31H,4-14H2,1-3H3/t15-,16-,17-,18-,19+,20-,21-,22-,23+,24-,25-,26-,27+/m0/s1 |
| SMILES |
C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@@H]1[C@H](C2)O[C@@]2([C@H]1C)NC[C@H](C[C@H]2O)CO)C)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
L-Arg Cholesterol |
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Solanaceae | Solanum lycopersicum MILL.  | Ref. |
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