Name |
Trikamsteroside E (-)-Trikamsteroside E |
Formula |
C48H76O23 |
Mw |
1020.47773874 |
CAS RN |
952579-37-2 |
C_ID |
C00032416
,
|
InChIKey |
PAUALFMTFPEINK-VOTNBRIANA-N |
InChICode |
InChI=1S/C48H76O23/c1-18-13-65-48(39(59)31(18)54)25(12-49)30-28(71-48)11-24-22-6-5-20-9-21(51)10-29(46(20,4)23(22)7-8-45(24,30)3)67-43-38(36(27(53)15-63-43)68-41-34(57)33(56)26(52)14-62-41)70-42-35(58)37(32(55)19(2)66-42)69-44-40(60)47(61,16-50)17-64-44/h5,18-19,21-44,49-61H,6-17H2,1-4H3/t18-,19-,21+,22+,23-,24-,25-,26+,27-,28-,29+,30-,31-,32-,33-,34+,35+,36-,37+,38+,39-,40-,41-,42-,43-,44-,45-,46-,47+,48-/m0/s1 |
SMILES |
C1[C@@H](CC2=CC[C@@H]3[C@@H]([C@]2([C@@H]1O[C@@H]1OC[C@@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)C)O)O[C@@H]1OC[C@]([C@H]1O)(O)CO)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)C)CC[C@]1([C@H]3C[C@H]2[C@@H]1[C@@H]([C@@]1(O2)OC[C@@H]([C@@H]([C@@H]1O)O)C)CO)C)O |
Start Substs in Alk. Biosynthesis (Prediction) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Trilliaceae | Trillium kamtschaticum PALL. | Ref. |
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Organism | Trillium kamtschaticum PALL. | Reference | Ono,Chem.Pharm.Bull.,55,(2007),1093 |
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