Basic information
- CAS
28008-51-7- Standard SMILES
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)O)C[C@@H]3O- InChIKey
OWCHPBVMSHIYCQ-VNMREYGJSA-N- Molecular formula
- C21H20O8
- Average molar mass
- 400.4 g/mol
- Monoisotopic mass
- 400.11581759
Names & identifiers
- Preferred name
- 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-(1S)-1-hydroxyethyl-1-methoxy-, (8S,10S)-
- IUPAC
- (7S,9S)-6,7,9,11-tetrahydroxy-9-(1-hydroxyethyl)-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione
- English name
- 5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-(1S)-1-hydroxyethyl-1-methoxy-, (8S,10S)-
- Molecular formula
- C21H20O8
- Molecular weight
- 400.38
Names & synonyms
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-[(1S)-1-hydroxyethyl]-1-methoxy-, (8S,10S)-5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-((1S)-1-hydroxyethyl)-1-methoxy-, (8S,10S)-RefChem:5276045,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-(1S)-1-hydroxyethyl-1-methoxy-, (8S,10S)-Daunorubicin EP Impurity E28008-51-7(8S,10S)-6,8,10,11-tetrahydroxy-8-(1-hydroxyethyl)-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dioneDaunorubicinol aglyconeDihydrodaunomycinone (MIxture of Diastereomers)(8S,10S)-7,8,9,10-Tetrahydro-6,8,10,11-tetrahydroxy-8-(1-hydroxyethyl)-1-methoxy-5,12-naphthacenedione228PJ9T8WQ13-DIHYDRODAUNORUBICINONE
Show more names
Daunorubicin Impurity 412-hydroxy-6-(methylthio)butanamideDaunorubicin Impurity 5(Daunorubicin EP Impurity E)
DTXSID40950696OWCHPBVMSHIYCQ-VNMREYGJSA-N5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-(1-hydroxyethyl)-1-methoxy-, (8S,10S)-DAUNORUBICIN HYDROCHLORIDE IMPURITY E [EP IMPURITY](8S,10S)-6,8,10,11-TETRAHYDROXY-8-((1RS)-1-HYDROXYETHYL)-1-METHOXY-7,8,9,10-TETRAHYDROTETRACENE-5,12-DIONE6,8,10,11-Tetrahydroxy-8-(1-hydroxyethyl)-1-methoxy-7,8,9,10-tetrahydrotetracene-5,12-dione
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 682
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory Information
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,10,11-tetrahydroxy-8-(1S)-1-hydroxyethyl-1-methoxy-, (8S,10S)-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Chemistry & industry
Suppliers11 total
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
山东沃德森生物科技有限公司0531-88723173 18596073690 · [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]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳摩科生化科技有限公司18627923403 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
湖北摩科化学有限公司18627753421; 18627756402 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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