| Name |
Ternstroemiaside A
(-)-Ternstroemiaside A |
| Formula |
C54H88O24 |
| Mw |
1120.56655374 |
| CAS RN |
625081-40-5 |
| C_ID |
C00045100
, 
|
| InChIKey |
BUIOZZJEVAFSTE-PBEXFCLONA-N |
| InChICode |
InChI=1S/C54H88O24/c1-21-31(60)34(63)37(66)45(71-21)77-42-36(65)33(62)25(19-56)73-47(42)75-40-39(68)41(44(69)70)76-48(43(40)78-46-38(67)35(64)32(61)24(18-55)72-46)74-30-12-13-51(6)26(50(30,4)5)11-14-52(7)27(51)10-9-22-23-15-49(2,3)16-28(58)54(23,20-57)29(59)17-53(22,52)8/h9,21,23-43,45-48,55-68H,10-20H2,1-8H3,(H,69,70)/t21-,23-,24+,25+,26-,27+,28-,29+,30-,31-,32+,33-,34+,35-,36-,37+,38+,39-,40-,41-,42+,43+,45-,46-,47-,48+,51-,52+,53+,54+/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](O[C@H]3[C@H](O)[C@@H](C(=O)O)O[C@@H](O[C@H]4CC[C@]5(C)[C@H]6CC=C7[C@@H]8CC(C)(C)C[C@H](O)[C@]8(CO)[C@H](O)C[C@@]7(C)[C@]6(C)CC[C@H]5C4(C)C)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Theaceae/Pentaphylacaceae/Ternstroemiaceae | Ternstroemia japonica | Ref. |
| - | - | Ternstromia japonica | Ref. |
|
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