Fibrostatin E
(2R)-2-acetamido-3-[[1-hydroxy-7-(hydroxymethyl)-3-methoxy-5,8-dioxonaphthalen-2-yl]methylsulfanyl]propanoic acid
| Molecular Formula | C18H19NO8S |
|---|---|
| Molecular Weight | 409.4 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 176.0 A2 |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 409.08313 |
| Heavy Atoms | 28 |
| Complexity | 678.0 |
Chemical Identifiers
| CAS Number | 91776-44-2 |
|---|---|
| SMILES | CC(=O)NC(CSCC1=C(C=C2C(=O)C=C(C(=O)C2=C1O)CO)OC)C(=O)O |
| InChIKey | XMGJRXDFMZYRQG-LBPRGKRZSA-N |
📖 Product Overview
Fibrostatin E (CAS: 91776-44-2) is a chemical compound with molecular formula C18H19NO8S and molecular weight 409.4 g/mol. Its IUPAC systematic name is (2R)-2-acetamido-3-[[1-hydroxy-7-(hydroxymethyl)-3-methoxy-5,8-dioxonaphthalen-2-yl]methylsulfanyl]propanoic acid.
XMGJRXDFMZYRQG-LBPRGKRZSA-N.
SMILES: CC(=O)NC(CSCC1=C(C=C2C(=O)C=C(C(=O)C2=C1O)CO)OC)C(=O)O.
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