| Name |
Sinocrassuloside IV |
| Formula |
C48H74O20 |
| Mw |
970.47734481 |
| CAS RN |
724784-98-9 |
| C_ID |
C00032144
, 
|
| InChIKey |
UIXPJVJPQYIJCB-BRSMZAOCNA-N |
| InChICode |
InChI=1S/C48H74O20/c1-23(39(60)61)24-11-13-46(6)29(45(24,5)12-8-16-49)10-9-25-26-17-43(2,3)14-15-48(26,30(50)18-47(25,46)7)42(62)68-41-38(59)36(57)34(55)28(67-41)22-65-40-37(58)35(56)33(54)27(66-40)21-64-32(53)20-44(4,63)19-31(51)52/h9,24,26-30,33-38,40-41,49-50,54-59,63H,1,8,10-22H2,2-7H3,(H,51,52)(H,60,61)/t24-,26-,27+,28+,29+,30+,33+,34+,35-,36-,37+,38+,40+,41-,44+,45+,46+,47+,48+/m0/s1 |
| SMILES |
C=C(C(=O)O)[C@@H]1CC[C@]2(C)[C@H](CC=C3[C@@H]4CC(C)(C)CC[C@]4(C(=O)O[C@@H]4O[C@H](CO[C@@H]5O[C@H](COC(=O)C[C@](C)(O)CC(=O)O)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)C[C@]32C)[C@@]1(C)CCCO |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Crassulaceae | Sinocrassula asclepiadea FRANCH | Ref. |
|
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