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Blazein

Blazein structure

Blazein 

structure
  • CAS No:

    126060-09-1

  • Formula:

    C29H48O3

  • Chemical Name:

    Blazein

  • Synonyms:

    Ergosta-7,22-diene-3,5-diol,6-methoxy-,(3β,5α,6β,22E)-;(3β,5α,6β,22E)-6-Methoxyergosta-7,22-diene-3,5-diol;6-O-Methylcerevisterol;Blazein;2244768-39-4

  • Categories:

    Natural Products  >  Steroids

Description

Blazein is an ergostanoid that is (22E)-ergosta-7,22-diene substituted by hydroxy groups at positions 3 and 5 and a methoxy group at position 6 (the 3beta,5alpha stereoisomer). It has been isolated from the fungus, Xylaria species. It has a role as a fungal metabolite. It is a 3beta-hydroxy steroid, an ergostanoid, a 5alpha-hydroxy steroid and an ether.

Blazein Basic Attributes

444.7

444.69

Characteristics

49.7

6.1

1.05±0.1 g/cm3(Predicted)

175 °C

539.4±50.0 °C(Predicted)

Drug Information

blazein

Computed Properties

Molecular Weight:444.7
XLogP3:6.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:444.36034539
Monoisotopic Mass:444.36034539
Topological Polar Surface Area:49.7
Heavy Atom Count:32
Complexity:756
Defined Atom Stereocenter Count:10
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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