Name |
alpha-Solanine |
Formula |
C45H73NO15 |
Mw |
867.49802067 |
CAS RN |
20562-02-1 |
C_ID |
C00002262
,
|
InChIKey |
ZGVSETXHNHBTRK-HZKUNUFRNA-N |
InChICode |
InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3/t19-,20+,21-,23-,24+,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37+,38-,39-,40+,41-,42-,43-,44-,45-/m0/s1 |
SMILES |
CC1O[C@@H](OC2[C@H](O[C@H]3CC[C@@]4(C)C(=CC[C@H]5[C@@H]6C[C@H]7[C@H]([C@H](C)[C@@H]8CC[C@H](C)CN87)[C@@]6(C)CC[C@@H]54)C3)OC(CO)[C@H](O)[C@@H]2O[C@@H]2OC(CO)[C@@H](O)[C@H](O)C2O)C(O)[C@@H](O)[C@H]1O |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Solanaceae | Solanum acaule | Ref. |
Plantae | Solanaceae | Solanum americanum | Ref. |
Plantae | Solanaceae | Solanum bulbocastanum | Ref. |
Plantae | Solanaceae | Solanum canasense | Ref. |
Plantae | Solanaceae | Solanum chacoense | Ref. |
Plantae | Solanaceae | Solanum chenopodioides | Ref. |
Plantae | Solanaceae | Solanum commersonii | Ref. |
Plantae | Solanaceae | Solanum fendleri | Ref. |
Plantae | Solanaceae | Solanum hougasii | Ref. |
Plantae | Solanaceae | Solanum lycopersicum | Ref. |
Plantae | Solanaceae | Solanum multidissectum | Ref. |
Plantae | Solanaceae | Solanum nigrum | Ref. |
Plantae | Solanaceae | Solanum phureja | Ref. |
Plantae | Solanaceae | Solanum pinnacritisectum | Ref. |
Plantae | Solanaceae | Solanum spp. | Ref. |
Plantae | Solanaceae | Solanum stoloniferum | Ref. |
Plantae | Solanaceae | Solanum tarijense | Ref. |
Plantae | Solanaceae | Solanum tuberosum | Ref. |
Plantae | Solanaceae | Solanum villosum | Ref. |
|
|
zoom in
Organism | Solanum acaule | Reference | Aversano, R. et al., Phytochemistry, 137, (2017), 42-51. |
---|
|