| Name |
Polygonatoside B3
(-)-Polygonatoside B3 |
| Formula |
C39H62O13 |
| Mw |
738.41904207 |
| CAS RN |
55916-51-3 |
| C_ID |
C00048513
, 
|
| InChIKey |
WHWWQGPCTUQCMN-DJTQZGRPNA-N |
| InChICode |
InChI=1S/C39H62O13/c1-18-8-13-38(47-17-18)20(3)39(46)27(52-38)15-25-23-7-6-21-14-22(9-11-36(21,4)24(23)10-12-37(25,39)5)49-35-33(31(44)29(42)26(16-40)50-35)51-34-32(45)30(43)28(41)19(2)48-34/h6,18-20,22-35,40-46H,7-17H2,1-5H3/t18-,19+,20-,22+,23-,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35-,36+,37+,38-,39-/m1/s1 |
| SMILES |
C1[C@H]2[C@H]([C@H]3[C@](C1)([C@@]1([C@H](C3)O[C@]3([C@H]1C)OC[C@@H](CC3)C)O)C)CC=C1[C@@]2(CC[C@@H](C1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O)O)O)O)CO)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Chenopodiaceae | Beta vulgaris  | Ref. |
|
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