| Name |
Basellasaponin D
(+)-Basellasaponin D |
| Formula |
C47H68O22 |
| Mw |
984.42022386 |
| CAS RN |
354552-06-0 |
| C_ID |
C00032758
, 
|
| InChIKey |
XRPQKQDVGUZFQR-VTVASLJHNA-N |
| InChICode |
InChI=1S/C47H68O22/c1-41(2)23-9-12-45(6)24(43(23,4)11-10-25(41)65-36-30(54)31-32(33(66-36)34(55)56)69-47(62,38(59)60)40(67-31)63-19-26(49)50)8-7-20-21-17-42(3,37(57)58)13-15-46(21,16-14-44(20,45)5)39(61)68-35-29(53)28(52)27(51)22(18-48)64-35/h7,21-25,27-33,35-36,40,48,51-54,62H,8-19H2,1-6H3,(H,49,50)(H,55,56)(H,57,58)(H,59,60)/t21-,22+,23-,24+,25-,27+,28-,29+,30+,31+,32+,33-,35-,36+,40-,42-,43-,44+,45+,46-,47-/m0/s1 |
| SMILES |
[C@]1(CC[C@]2([C@@H](C1)C1=CC[C@H]3[C@]([C@@]1(CC2)C)(CC[C@@H]1[C@@]3(CC[C@@H](C1(C)C)O[C@@H]1O[C@@H]([C@H]2[C@@H]([C@H]1O)O[C@@H]([C@](O2)(O)C(=O)O)OCC(=O)O)C(=O)O)C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)(C(=O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Basellaceae | Basella rubra L.  | Ref. |
|
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