 Home > Encyclopedia > 3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde

3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde

3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde structure

CAS No:
68455-08-3
Formula:
C21H20O6
Chemical Name:
3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde
Synonyms:
mollicellin G;Mollicellin G;UNII-M39FZR61JT;M39FZR61JT;68455-08-3;11H-Dibenzo(b,e)(1,4)dioxepin-4-carboxaldehyde, 3,8-dihydroxy-1,6-dimethyl-7-(3-methyl-2-butenyl)-11-oxo-;DTXSID30218570;Q27283427;UNII-B811E427JV component YCVIERNKAZOGOU-UHFFFAOYSA-N

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3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde Basic Attributes

Molecular Weight：

368.4 g/mol

Exact Mass：

368.12598835 g/mol

UNII：

M39FZR61JT

DSSTox ID：

DTXSID30218570

Characteristics

PSA：

93.1 Å²

Drug Information

MeSH Entry Terms：

mollicellin G

Computed Properties

Molecular Weight:368.4
XLogP3:4.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:368.12598835
Monoisotopic Mass:368.12598835
Topological Polar Surface Area:93.1
Heavy Atom Count:27
Complexity:598
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,9-dihydroxy-1,7-dimethyl-2-(3-methylbut-2-enyl)-6-oxobenzo[b][1,4]benzodioxepine-10-carbaldehyde

Basic Attributes
Characteristics
Drug Information
Computed Properties

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