Basic information
- CAS
77184-75-9- Standard SMILES
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCCNCCO)ccc(O)c21- InChIKey
UHSACPVLAHYVQL-UHFFFAOYSA-N- Molecular formula
- C18H18N2O6
- Average molar mass
- 358.3 g/mol
- Monoisotopic mass
- 358.1164863
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,4,5-trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)-
- IUPAC
- 1,4,5-trihydroxy-8-[2-(2-hydroxyethylamino)ethylamino]anthracene-9,10-dione
- English name
- 1,4,5-Trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)-9,10-anthra cenedione
- Molecular formula
- C18H18N2O6
- Molecular weight
- 358.35
Names & synonyms
77184-75-99,10-Anthracenedione, 1,4,5-trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)-1,4,5-Trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)anthracene-9,10-dione1,4,5-TRIHYDROXY-8-({2-[(2-HYDROXYETHYL)AMINO]ETHYL}AMINO)ANTHRACENE-9,10-DIONESCHEMBL11391594DTXSID30227940UHSACPVLAHYVQL-UHFFFAOYSA-N1,4,5-Trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)-9,10-anthracenedione1-[[2-(2-Hydroxyethylamino)ethyl]amino]-4,5,8-trihydroxyanthraquinoneMitoxantrone Impurity 261,4,5-Trihydroxy-8-((2-((2-hydroxyethyl)amino)ethyl)amino)-9,10-anthra cenedione9,10-Anthracenedione, 1,4,5-trihydroxy-8-[[2-[(2-hydroxyethyl)amino]ethyl]amino]-
Database identifiers
- CAS
77184-75-9- PubChem CID
- 149585
- DTXSID
DTXSID30227940
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 530
Chemistry & industry
Suppliers3 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
广州九植医药科技有限公司020-89854820 · [email protected]
深圳市洛克医药科技有限公司13128912434 · [email protected]
Related reactions
1 records
Compound notes
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