| Name |
Luperoside I |
| Formula |
C70H110O35 |
| Mw |
1510.68276529 |
| CAS RN |
124761-32-6 |
| C_ID |
C00039664
, 
|
| InChIKey |
GNLYEGHDTBBEHJ-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C70H110O35/c1-25-36(75)41(80)46(85)59(94-25)101-51-37(76)26(2)95-62(54(51)103-60-48(87)43(82)50(27(3)96-60)99-57-44(83)38(77)30(73)22-92-57)105-64(91)70-18-16-65(4,5)20-29(70)28-10-11-34-66(6)14-13-35(67(7,24-72)33(66)12-15-69(34,9)68(28,8)17-19-70)98-63-55(104-61-47(86)42(81)40(79)32(21-71)97-61)52(49(88)53(102-63)56(89)90)100-58-45(84)39(78)31(74)23-93-58/h10,24-27,29-55,57-63,71,73-88H,11-23H2,1-9H3,(H,89,90)/t25-,26-,27-,29-,30-,31-,32+,33-,34+,35+,36+,37-,38-,39+,40+,41-,42-,43-,44-,45+,46-,47+,48-,49+,50-,51-,52+,53+,54-,55-,57+,58-,59-,60-,61+,62+,63-,66+,67+,68-,69-,70-/m1/s1 |
| SMILES |
C1[C@@H]([C@]([C@H]2[C@](C1)([C@H]1[C@@](CC2)([C@]2(C(=CC1)[C@@H]1[C@](CC2)(CCC(C1)(C)C)C(=O)O[C@@H]1O[C@@H]([C@H]([C@H]([C@H]1O[C@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O[C@@H]1OC[C@H]([C@H]([C@H]1O)O)O)C)O[C@H]1O[C@@H]([C@@H]([C@H]([C@H]1O)O)O)C)O)C)C)C)C)(C=O)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)CO)O)O)O)O[C@@H]1[C@H]([C@H]([C@@H](CO1)O)O)O)O)C(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Cucurbitaceae | Luffa operculata  | Ref. |
|
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