| Name |
Atriplicosaponin B
(+)-Atriplicosaponin B |
| Formula |
C42H70O14S |
| Mw |
830.44862768 |
| CAS RN |
870467-24-6 |
| C_ID |
C00031614
, 
|
| InChIKey |
NKGFVUZXSKFRND-UWRIKVBPNA-N |
| InChICode |
InChI=1S/C42H70O14S/c1-21-11-14-39(6)17-18-42(20-44)24(29(39)22(21)2)9-10-27-40(7)15-13-28(38(4,5)26(40)12-16-41(27,42)8)54-37-35(56-57(49,50)51)33(48)34(23(3)52-37)55-36-32(47)31(46)30(45)25(19-43)53-36/h9,21-23,25-37,43-48H,10-20H2,1-8H3,(H,49,50,51)/t21-,22+,23-,25-,26+,27-,28+,29+,30-,31+,32-,33+,34-,35-,36+,37+,39-,40+,41-,42+/m1/s1 |
| SMILES |
[C@H]1(CC[C@]2([C@@H]([C@H]1C)C1=CC[C@H]3[C@]([C@@]1(CC2)CO)(CC[C@@H]1[C@@]3(CC[C@@H](C1(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1OS(=O)(=O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)C)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Zygophyllaceae | Zygophyllum atriplicoides | Ref. |
|
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