| Name |
Sinocrassuloside III
(+)-Sinocrassuloside III |
| Formula |
C55H86O25 |
| Mw |
1146.5458183 |
| CAS RN |
724784-97-8 |
| C_ID |
C00032143
, 
|
| InChIKey |
IDOCSOXSHBGSHL-JGJQIVQNNA-N |
| InChICode |
InChI=1S/C55H86O25/c1-49(2)15-16-55(25(17-49)24-9-10-29-51(4)13-12-31(57)54(7,47(69)70)30(51)11-14-52(29,5)53(24,6)18-32(55)58)48(71)80-46-42(68)43(79-45-41(67)38(64)35(61)26(21-56)76-45)37(63)28(78-46)23-75-44-40(66)39(65)36(62)27(77-44)22-74-34(60)20-50(3,72)19-33(59)73-8/h9,25-32,35-46,56-58,61-68,72H,10-23H2,1-8H3,(H,69,70)/t25-,26+,27+,28+,29+,30+,31-,32+,35-,36-,37+,38-,39-,40+,41+,42+,43-,44+,45+,46-,50+,51+,52+,53+,54-,55+/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)O[C@H]1O[C@@H]([C@@H]([C@@H]([C@H]1O)O)O)CO)O)CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)COC(=O)C[C@@](CC(=O)OC)(O)C)O)O)O)C)C)C)(C)C(=O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Crassulaceae | Sinocrassula asclepiadea FRANCH | Ref. |
|
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