Basic information
- CAS
3571-31-1- Standard SMILES
COc1cc(O)c2c(c1)Cc1cc(C)cc(O)c1C2=O- InChIKey
DRQZSQDHMHEDQS-UHFFFAOYSA-N- Molecular formula
- C16H14O4
- Average molar mass
- 270.28 g/mol
- Monoisotopic mass
- 270.08920892
Overview
Anthrone, 1,8-dihydroxy-3-methoxy-6-methyl- has been reported in Aspergillus wentii, Ventilago madraspatana, and other organisms with data available.
Names & identifiers
- Preferred name
- 1,8-Dihydroxy-3-methoxy-6-methyl-9(10H)-anthracenone
- IUPAC
- 1,8-dihydroxy-3-methoxy-6-methyl-10H-anthracen-9-one
- English name
- PHYSCIONANTHRONEB
- Molecular formula
- C16H14O4
- Molecular weight
- 270.28
Names & synonyms
Physcionanthrone BPhyscion anthronePhyscion-9-anthrone3571-31-172PNO71IWV9(10H)-Anthracenone, 1,8-dihydroxy-3-methoxy-6-methyl-NSC-1794881,8-DIHYDROXY-3-METHOXY-6-METHYL-9(10H)-ANTHRACENONERefChem:1053587ANTHRONE, 1,8-DIHYDROXY-3-METHOXY-6-METHYL-1,8-dihydroxy-6-methoxy-3-methyl-9-anthroneCCRIS 6423
Show more names
ANTHRONE,1,8-DIHYDROXY-3-METHOXY-6-METHYL-
NSC 179488BRN 19931521,8-Dihydroxy-3-methoxy-6-methylanthroneNSC179488PHYSCIONANTHRONEBUNII-72PNO71IWV4-06-00-07808 (Beilstein Handbook Reference)1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one
Database identifiers
- CAS
3571-31-1- PubChem CID
- 19132
- DTXSID
DTXSID60189229- UNII
- 72PNO71IWV
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 383
Physicochemical properties
- FDA UNII
- 72 PNO71IWV · 72PNO71IWV
Chemistry & industry
Suppliers2 total
吉林中科研伸科技有限公司18143011203 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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