| Name |
Khekadaengoside A
(-)-Khekadaengoside A |
| Formula |
C42H64O16 |
| Mw |
824.419436 |
| CAS RN |
415710-99-5 |
| C_ID |
C00037374
, 
|
| InChIKey |
UFINFGVQJXYBJL-XERDXNEXNA-N |
| InChICode |
InChI=1S/C42H64O16/c1-18-27(47)29(49)31(51)35(55-18)58-32-30(50)28(48)23(17-43)57-36(32)56-22-14-20-19(38(4,5)34(22)52)10-11-24-39(6)15-21(44)33(40(39,7)16-26(46)41(20,24)8)42(9,54)25(45)12-13-37(2,3)53/h10,14,18,20-21,23-24,27-33,35-36,43-44,47-51,53-54H,11-13,15-17H2,1-9H3/t18-,20+,21+,23+,24-,27-,28+,29+,30-,31+,32+,33-,35-,36+,39-,40+,41-,42-/m0/s1 |
| SMILES |
C[C@@H]1O[C@@H](O[C@H]2[C@H](OC3=C[C@@H]4C(=CCC5[C@]6(C)C[C@@H](O)[C@H]([C@@](C)(O)C(=O)CCC(C)(C)O)[C@@]6(C)CC(=O)[C@]54C)C(C)(C)C3=O)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 | Cucurbitaceae | Trichosanthes tricuspidata | Ref. |
|
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