| Name |
Aquastatin A |
| Formula |
C36H52O12 |
| Mw |
676.34587713 |
| CAS RN |
153821-50-2 |
| C_ID |
C00016903
, 
|
| InChIKey |
PAQGKQJWHLLQLF-MUKNXSQPNA-N |
| InChICode |
InChI=1S/C36H52O12/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-23-18-25(47-36-33(42)32(41)31(40)28(21-37)48-36)20-27(39)30(23)35(45)46-24-17-22(2)29(34(43)44)26(38)19-24/h17-20,28,31-33,36-42H,3-16,21H2,1-2H3,(H,43,44)/t28-,31-,32-,33+,36+/m0/s1 |
| SMILES |
O(c1cc(c(c(c1)O)C(=O)Oc1cc(c(c(c1)C)C(=O)O)O)CCCCCCCCCCCCCCC)[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)CO)O)O)O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Fungi | Nectriaceae | Fusarium aquaeductuum SANK 11089 | Ref. |
|
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