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5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione

5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione structure

CAS No:
71593-10-7
Formula:
C19H20O7
Chemical Name:
5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione
Synonyms:
abruquinone A;Abroquinone A;Abruquinone A;71593-10-7;2,5-Cyclohexadiene-1,4-dione, 5-(3,4-dihydro-6,7-dimethoxy-2H-1-benzopyran-3-yl)-2,3-dimethoxy-, (S)-;DTXSID70992145;5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione;5-(6,7-Dimethoxy-3,4-dihydro-2H-1-benzopyran-3-yl)-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione

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5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione Basic Attributes

Molecular Weight：

360.4 g/mol

Exact Mass：

360.12090297 g/mol

Characteristics

PSA：

80.3 Å²

Drug Information

MeSH Entry Terms：

abruquinone A

Computed Properties

Molecular Weight:360.4
XLogP3:2.1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:360.12090297
Monoisotopic Mass:360.12090297
Topological Polar Surface Area:80.3
Heavy Atom Count:26
Complexity:636
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(3S)-6,7-dimethoxy-3,4-dihydro-2H-chromen-3-yl]-2,3-dimethoxycyclohexa-2,5-diene-1,4-dione

Basic Attributes
Characteristics
Drug Information
Computed Properties

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