Basic information
- CAS
476-46-0- Standard SMILES
Cc1cc(O)c2c(c1O)C(=O)c1cc(O)cc(O)c1C2=O- InChIKey
VWDXGKUTGQJJHJ-UHFFFAOYSA-N- Molecular formula
- C15H10O6
- Average molar mass
- 286.24 g/mol
- Monoisotopic mass
- 286.04773803
Overview
4-hydroxyemodin has been reported in Talaromyces islandicus, Aspergillus ruber, and other organisms with data available.
Names & identifiers
- Preferred name
- Catenarin
- IUPAC
- 1,4,5,7-tetrahydroxy-2-methylanthracene-9,10-dione
- English name
- CATENARIN
- Molecular formula
- C15H10O6
- Molecular weight
- 286.24
Names & synonyms
CATENARIN476-46-0Caterarin4-Hydroxyemodin1,4,5,7-tetrahydroxy-2-methylanthracene-9,10-dioneEHN5P96V6SAnthraquinone, 1,4,5,7-tetrahydroxy-2-methyl-9,10-Anthracenedione, 1,4,5,7-tetrahydroxy-2-methyl-DTXSID50197212RefChem:123982DTXCID60119703Katenarin
Show more names
CATENARIN(RG)Emodin Impurity 281,4,5,7-tetrahydroxy-2-methyl-anthraquinon2-methyl-1,4,5,7-tetrahydroxy-10-anthracenedione1,4,5,7-tetrahydroxy-2-methyl-9,10-anthraquinone
1,4,6,8-TETRAHYDROXY-3-METHYLANTHRAQUINONE1,4,5,7-Tetrahydroxy-2-methylanthraquinone9,10-ANTHRACENEDIONE, 2-METHYL-1,4,5,7-TETRAHYDROXY-NSC-3440221,4,5,7-tetrahydroxy-2-methyl-anthracene-9,10-dioneCCRIS 5308NSC 344022BRN 2061086
Database identifiers
- CAS
476-46-0- PubChem CID
- 10150
- DTXSID
DTXSID50197212- ChEMBL
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 463
Physicochemical properties
- Melting point
- 246 ℃ · 246℃
- FDA UNII
- 5 P96V6S · EHN5P96V6S
Chemistry & industry
Applications
Uses1,4,6,8-Tetrahydroxy-3-methylanthraquinone is an anthraquinones in the fungus Talaromyces stipitatus.
Suppliers15 total
成都乐美天医药科技有限公司17308096051 17308096051 · [email protected]
上海纯优生物科技有限公司15921393123 18302135232 · [email protected]
成都健腾生物技术有限公司028-85159085 18080455027 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
四川百奥克睿生物科技有限公司28-86-28-8543-3893 13260669172 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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