| Name |
Rubicunoside C
(-)-Rubicunoside C |
| Formula |
C72H112O38 |
| Mw |
1584.68315922 |
| CAS RN |
180965-44-0 |
| C_ID |
C00040172
, 
|
| InChIKey |
WWXTUQDTGKVRDN-WRSKBWLLNA-N |
| InChICode |
InChI=1S/C72H112O38/c1-25-51(104-59-44(86)38(80)30(77)22-96-59)42(84)47(89)61(98-25)105-52-26(2)99-64(56(49(52)91)108-63-48(90)43(85)53(100-27(3)76)33(21-74)102-63)110-66(95)72-17-16-67(4,5)18-29(72)28-10-11-35-68(6)14-13-37(69(7,24-75)34(68)12-15-70(35,8)71(28,9)19-36(72)79)103-65-57(109-62-46(88)41(83)40(82)32(20-73)101-62)54(50(92)55(107-65)58(93)94)106-60-45(87)39(81)31(78)23-97-60/h10,24-26,29-57,59-65,73-74,77-92H,11-23H2,1-9H3,(H,93,94)/t25-,26+,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-,56+,57+,59-,60-,61-,62-,63-,64-,65+,68-,69-,70+,71+,72+/m0/s1 |
| SMILES |
C1[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)CO)OC(=O)C)O)O)O)O[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)C)C)C)C)(C=O)C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O[C@@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Caryophyllaceae | Silene rubicunda | Ref. |
|
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