| Name |
Perennisaponin C
(-)-Perennisaponin C |
| Formula |
C65H104O28 |
| Mw |
1332.67141274 |
| CAS RN |
1033766-71-0 |
| C_ID |
C00030963
, 
|
| InChIKey |
KQMYBSQTPZRVGO-FDANZOANNA-N |
| InChICode |
InChI=1S/C65H104O28/c1-27(67)19-40(71)84-28(2)20-41(72)85-29(3)21-42(73)89-52-32(6)88-58(53(50(52)81)91-56-49(80)46(77)51(31(5)87-56)90-55-47(78)44(75)36(69)25-83-55)93-59(82)65-18-17-60(7,8)22-34(65)33-13-14-38-61(9)23-35(68)54(92-57-48(79)45(76)43(74)30(4)86-57)62(10,26-66)37(61)15-16-63(38,11)64(33,12)24-39(65)70/h13,27-32,34-39,43-58,66-70,74-81H,14-26H2,1-12H3/t27-,28-,29-,30-,31-,32+,34-,35-,36+,37+,38+,39+,43-,44-,45+,46-,47+,48+,49+,50-,51-,52-,53+,54-,55-,56-,57-,58+,61-,62-,63+,64+,65+/m0/s1 |
| SMILES |
[C@H]1([C@@H]([C@@]([C@H]2[C@](C1)([C@@H]1[C@@](CC2)([C@]2(C(=CC1)[C@H]1[C@@]([C@@H](C2)O)(CCC(C1)(C)C)C(=O)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[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)O)O)OC(=O)C[C@H](C)OC(=O)C[C@H](C)OC(=O)C[C@@H](O)C)C)C)C)C)(C)CO)O[C@@H]1O[C@H]([C@@H]([C@H]([C@H]1O)O)O)C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Asteraceae | Bellis perennis  | Ref. |
|
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