| Name |
2alpha,3alpha,19alpha,24-Tetrahydroxyurs-12-en-28-oic acid 28-O-beta-D-glucopyranosyl ester
(-)-4-Epi-niga-ichigoside F1 |
| Formula |
C36H58O11 |
| Mw |
666.3979127 |
| CAS RN |
105706-14-7 |
| C_ID |
C00031544
, 
|
| InChIKey |
WKKBYJLXSKPKSC-DOHXSJLANA-N |
| InChICode |
InChI=1S/C36H58O11/c1-18-9-12-36(30(44)47-29-26(42)25(41)24(40)21(16-37)46-29)14-13-33(4)19(27(36)35(18,6)45)7-8-23-31(2)15-20(39)28(43)32(3,17-38)22(31)10-11-34(23,33)5/h7,18,20-29,37-43,45H,8-17H2,1-6H3/t18-,20-,21-,22-,23-,24-,25+,26-,27-,28+,29+,31-,32-,33-,34-,35-,36+/m1/s1 |
| SMILES |
C[C@@H]1CC[C@]2(C(=O)OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](O)[C@H](O)[C@](C)(CO)[C@@H]5CC[C@]43C)[C@@H]2[C@]1(C)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rosaceae | Prunus serrulate var. spontanea | Ref. |
|
|
zoom in
|
