| Name |
Pentandroside G |
| Formula |
C61H100O32 |
| Mw |
1344.6197711 |
| CAS RN |
811799-68-5 |
| C_ID |
C00035868
, 
|
| InChIKey |
UQZPIWLVCRZJBY-IIHJIHNLNA-N |
| InChICode |
InChI=1S/C61H100O32/c1-22(19-81-54-47(78)44(75)41(72)33(16-62)87-54)6-9-36(68)86-32-15-29-27-8-7-25-14-26(10-12-60(25,4)28(27)11-13-61(29,5)37(32)23(2)65)85-58-52(92-57-48(79)43(74)38(69)24(3)84-57)49(80)50(35(18-64)89-58)90-59-53(93-56-46(77)40(71)31(67)21-83-56)51(42(73)34(17-63)88-59)91-55-45(76)39(70)30(66)20-82-55/h22,24-35,37-59,62-64,66-67,69-80H,6-21H2,1-5H3/t22-,24-,25-,26-,27+,28-,29-,30+,31+,32-,33+,34+,35+,37-,38-,39-,40-,41+,42+,43+,44-,45+,46+,47+,48+,49-,50-,51-,52+,53+,54+,55-,56-,57-,58+,59-,60-,61+/m0/s1 |
| SMILES |
C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@@](CC1)([C@H]([C@H](C2)OC(=O)CC[C@@H](CO[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)C)C(=O)C)C)C)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[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Zygophyllaceae | Tribulus pentandrus | Ref. |
|
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