Name |
Ginsenoside Ia |
Formula |
C42H72O14 |
Mw |
800.49220701 |
CAS RN |
177745-52-7 |
C_ID |
C00030392
,
|
InChIKey |
AVTXSAWPGCSYFO-QOGHZXCRNA-N |
InChICode |
InChI=1S/C42H72O14/c1-20(2)10-9-13-42(8,56-37-34(52)32(50)30(48)25(19-44)54-37)21-11-15-40(6)28(21)22(45)16-26-39(5)14-12-27(38(3,4)35(39)23(46)17-41(26,40)7)55-36-33(51)31(49)29(47)24(18-43)53-36/h10,21-37,43-52H,9,11-19H2,1-8H3/t21-,22+,23-,24+,25+,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36-,37-,39+,40+,41+,42-/m0/s1 |
SMILES |
C1[C@@H](C([C@H]2[C@](C1)([C@@H]1[C@@](C[C@@H]2O)([C@]2([C@H]([C@@H](C1)O)[C@H](CC2)[C@@](O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)(CCC=C(C)C)C)C)C)C)(C)C)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Araliaceae | Panax ginseng | Ref. |
Plantae | Araliaceae | Panax quinquefolium L. | Ref. |
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zoom in
Organism | Panax quinquefolium L. | Reference | Nakamura,Chem.Pharm.Bull.,55,(2007),1342 |
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