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Diatoxanthin

Diatoxanthin structure

Diatoxanthin 

structure
  • CAS No:

    31063-73-7

  • Formula:

    C40H54O2

  • Chemical Name:

    Diatoxanthin

  • Synonyms:

    β,β-Carotene-3,3′-diol,7,8-didehydro-,(3R,3′R)-;β-Carotene-3,3′-diol,7,8-didehydro-,(3R,3′R)-all-trans-;(3R,3′R)-7,8-Didehydro-β,β-carotene-3,3′-diol;Diatoxanthin;Diatoxanthin,all-trans-;all-trans-Diatoxanthin;18524-95-3;27405-34-1

Description

Diatoxanthin is a triterpenoid.

Diatoxanthin Basic Attributes

566.86

566.86

3VOI529I46

Characteristics

40.5

9.99460

1.02g/cm3

708.3ºC at 760 mmHg

272.9ºC

1.568

Safety Information

NONH for all modes of transport

Drug Information

all-trans-diatoxanthin

Diatoxanthin Use and Manufacturing

Lipids -> Prenol Lipids [PR] -> Isoprenoids [PR01] -> C40 isoprenoids (tetraterpenes) [PR0107]

Computed Properties

Molecular Weight:566.9
XLogP3:10.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:566.412380961
Monoisotopic Mass:566.412380961
Topological Polar Surface Area:40.5
Heavy Atom Count:42
Complexity:1360
Defined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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