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Isochamaejasmin

Isochamaejasmin structure

Isochamaejasmin 

structure
  • CAS No:

    93859-63-3

  • Formula:

    C30H22O10

  • Chemical Name:

    Isochamaejasmin

  • Synonyms:

    [3,3′-Bi-4H-1-benzopyran]-4,4′-dione,2,2′,3,3′-tetrahydro-5,5′,7,7′-tetrahydroxy-2,2′-bis(4-hydroxyphenyl)-,(2R,2′S,3S,3′R)-rel-;[3,3′-Bi-4H-1-benzopyran]-4,4′-dione,2,2′,3,3′-tetrahydro-5,5′,7,7′-tetrahydroxy-2,2′-bis(4-hydroxyphenyl)-,[2α,3β(2′S*,3′R*)]-;rel-(2R,2′S,3S,3′R)-2,2′,3,3′-Tetrahydro-5,5′,7,7′-tetrahydroxy-2,2′-bis(4-hydroxyphenyl)[3,3′-bi-4H-1-benzopyran]-4,4′-dione;Isochamaejasmin;Isochamaejasmin (ICM)

  • Categories:

    Natural Products  >  Flavonoids

Description

ChEBI: A biflavonoid that consists of two units of 5,7,4'-trihydroxyflavanone joined together at position 3 and 3''.


Isochamaejasmin is a biflavonoid that consists of two units of 5,7,4'-trihydroxyflavanone joined together at position 3 and 3''. It has a role as a plant metabolite. It is a biflavonoid and a hydroxyflavone.

Isochamaejasmin Basic Attributes

542.48968

542.49

687700

Characteristics

174

4.6

Drug Information

isochamaejasmin

Isochamaejasmin Use and Manufacturing

Polyketides [PK] -> Flavonoids [PK12] -> Biflavonoids and polyflavonoids [PK1204]

Computed Properties

Molecular Weight:542.5
XLogP3:4.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:3
Exact Mass:542.12129689
Monoisotopic Mass:542.12129689
Topological Polar Surface Area:174
Heavy Atom Count:40
Complexity:854
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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