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Home > Encyclopedia > 3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde structure

3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde 

structure
  • CAS No:

    68455-09-4

  • Formula:

    C21H20O6

  • Chemical Name:

    3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

  • Synonyms:

    11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde,3,7-dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-;11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde,3,7-dihydroxy-1,9-dimethyl-8-(3-methyl-2-butenyl)-11-oxo-;3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde;Mollicellin H

Description

Mollicellin H is a member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by hydroxy groups at position 3 and 7, methyl group at positions 1 and 9, a prenyl group at position 8, an oxo group at position 11 and a formyl group at position 4. Isolated from Chaetomium brasiliense it exhibits cytotoxic activity. It has a role as an antineoplastic agent and a Chaetomium metabolite. It is an aldehyde, a member of depsidones, an organic heterotricyclic compound and a polyphenol.

3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde Basic Attributes

368.4 g/mol

368.38

1WRS31P3AM

DTXSID90218571

Characteristics

93.1 Ų

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

Guide of 3,7-Dihydroxy-1,9-dimethyl-8-(3-methyl-2-buten-1-yl)-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde

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