| Name |
Synaptoside A1 |
| Formula |
C60H92O32S |
| Mw |
1356.52924158 |
| CAS RN |
1016274-54-6 |
| C_ID |
C00048869
, 
|
| InChIKey |
NDRDSUYTOJZGAW-RYKOLHAONA-N |
| InChICode |
InChI=1S/C60H92O32S/c1-22(2)16-24(62)18-59(8)30-11-14-58(7)33-25(10-15-60(30,58)55(76)92-59)57(6)13-12-32(56(4,5)31(57)17-26(33)63)87-54-48(36(66)28(20-81-54)85-51-39(69)37(67)34(64)29(86-51)21-82-93(77,78)79)91-50-40(70)38(68)44(23(3)83-50)88-52-43(73)46(35(65)27(19-61)84-52)89-53-42(72)45(80-9)41(71)47(90-53)49(74)75/h22-23,27-32,34-48,50-54,61,64-73H,10-21H2,1-9H3,(H,74,75)(H,77,78,79)/t23-,27-,28-,29-,30-,31+,32+,34-,35-,36+,37+,38+,39-,40-,41+,42-,43-,44-,45+,46+,47+,48+,50+,51+,52+,53-,54+,57-,58+,59+,60-/m1/s1 |
| SMILES |
C1C2=C([C@]3([C@]4(C1)[C@H](CC3)[C@](OC4=O)(C)CC(=O)CC(C)C)C)C(=O)C[C@@H]1[C@@]2(CC[C@@H](C1(C)C)O[C@@H]1OC[C@H]([C@@H]([C@@H]1O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)C)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)OC)O)C(=O)O)O)CO)O)O)O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COS(=O)(=O)O)O)O)O)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Rubiaceae | Synapta maculata | Ref. |
|
|
zoom in
|
