| Name |
Azaspiracid 11 |
| Formula |
C48H73NO13 |
| Mw |
871.50819143 |
| CAS RN |
629656-62-8 |
| C_ID |
C00055214
|
| InChIKey |
DRTXFMNCJGKDKI-BIQUAMIWSA-N |
| InChICode |
InChI=1S/C48H73NO13/c1-25-14-34(10-9-33(50)18-40(51)52)56-44(20-25)11-12-47(62-44)31(7)17-35-36(59-47)19-38(55-35)43(53)48(54)32(8)16-28(4)41(61-48)29(5)22-45-21-26(2)15-37(57-45)42-39(58-45)23-46(60-42)30(6)13-27(3)24-49-46/h9-10,20,26-28,30-39,41-43,49-50,53-54H,5,11-19,21-24H2,1-4,6-8H3,(H,51,52)/b10-9+/t26-,27+,28+,30-,31+,32-,33+,34-,35+,36+,37+,38-,39+,41+,42+,43+,44-,45-,46-,47-,48-/m1/s1 |
| SMILES |
C=C(C[C@]12C[C@H](C)C[C@H](O1)[C@@H]1O[C@@]3(C[C@@H]1O2)NC[C@@H](C)C[C@H]3C)[C@H]1O[C@@](O)([C@@H](O)[C@H]2C[C@@H]3O[C@@]4(CC[C@]5(C=C(C)C[C@@H](/C=C/[C@H](O)CC(=O)O)O5)O4)[C@@H](C)C[C@@H]3O2)[C@H](C)C[C@@H]1C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Mytilus edulis  | Ref. |
|
|
zoom in
| Organism | Mytilus edulis |
|---|
| Reference | Satake, M. et al., JACS, 1998, 120, 9967-9968 (Azaspiracid 1) |
|---|
|
