| Name |
Toxadocic acid A |
| Formula |
C48H96O18S4 |
| Mw |
1088.54794918 |
| CAS RN |
152574-80-6 |
| C_ID |
C00040516
, 
|
| InChIKey |
OONWOGREVGTYST-UHFFFAOYNA-N |
| InChICode |
InChI=1S/C48H96O18S4/c1-3-5-7-25-35-44(63-67(51,52)53)37-27-17-11-9-13-19-29-39-46(65-69(57,58)59)41-31-21-15-16-23-33-43(48(49)50)34-24-22-32-42-47(66-70(60,61)62)40-30-20-14-10-12-18-28-38-45(64-68(54,55)56)36-26-8-6-4-2/h43-47H,3-42H2,1-2H3,(H,49,50)(H,51,52,53)(H,54,55,56)(H,57,58,59)(H,60,61,62)/t43-,44-,45-,46-,47+/m1/s1 |
| SMILES |
CCCCCC[C@@H](OS(=O)(=O)O)CCCCCCCCC[C@H](CCCCCCC[C@H](CCCCC[C@H](CCCCCCCCC[C@@H](CCCCCC)OS(=O)(=O)O)OS(=O)(=O)O)C(=O)O)OS(=O)(=O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| - | - | Toxadocia sp. | Ref. |
|
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