| Name |
Cucurbitacin E 2-O-beta-D-glucopyranoside
Cucurbitacin E-2-O-glucoside
Elaterinide
Gratiotoxin
alpha-Elaterin 2-D-glucopyranoside |
| Formula |
C38H54O13 |
| Mw |
718.35644181 |
| CAS RN |
1398-78-3 |
| C_ID |
C00030029
, 
|
| InChIKey |
QKEJRKXVLGOJMB-GOIWXMBMNA-N |
| InChICode |
InChI=1S/C38H54O13/c1-18(40)51-33(2,3)13-12-25(42)38(9,48)30-21(41)15-35(6)24-11-10-19-20(37(24,8)26(43)16-36(30,35)7)14-22(31(47)34(19,4)5)49-32-29(46)28(45)27(44)23(17-39)50-32/h10,12-14,20-21,23-24,27-30,32,39,41,44-46,48H,11,15-17H2,1-9H3/b13-12+/t20-,21-,23-,24+,27-,28+,29-,30+,32-,35+,36-,37+,38+/m1/s1 |
| SMILES |
C12=CC[C@@H]3[C@]([C@@H]1C=C(C(=O)C2(C)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)(C(=O)C[C@]1([C@]3(C[C@H]([C@@H]1[C@@](C(=O)/C=C/C(C)(C)OC(=O)C)(C)O)O)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Citrullus colocynthis (L.)  | Ref. |
| Plantae | Cucurbitaceae | Citrullus lanatus | Ref. |
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