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Basic information
- Standard SMILES
CCC(CC)ON(CC(O)C(Cc1ccccc1)NC(=O)OC1COC2OCCC12)S(=O)(=O)c1ccc(O)cc1- InChIKey
ALQRYWHLUHHGQY-UHFFFAOYSA-N- Molecular formula
- C28H38N2O9S
- Average molar mass
- 578.7 g/mol
- Monoisotopic mass
- 578.22980197
Names & identifiers
- IUPAC
- 2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-4-yl N-[3-hydroxy-4-[(4-hydroxyphenyl)sulfonyl-pentan-3-yloxyamino]-1-phenylbutan-2-yl]carbamate
Database identifiers
- PubChem CID
- 76493302
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 14
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 883
Related reactions
1 records
Compound notes
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