Aloeemodin

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Names

[ CAS No. ]:
481-72-1

[ Name ]:
Aloeemodin

[Synonym ]:
EINECS 207-571-7
Aloe emodin
MFCD00017373
1,8-Dihydroxy-3-(hydroxymethyl)anthracen-9,10-dion
1,8-Dihydroxy-3-(hydroxymethyl)anthraquinone
ALOE-EMODIN
Aloeemodin:9,10-Anthracenedione,1,8-dihydroxy-3-(hydroxymethyl)-,
Aloeemodin
1,8-Dihydroxy-3-(hydroxymethyl)anthraquinone,3-Hydroxymethylchrysazine,Aloe-emodin
3-Hydroxymethylchrysazine
EMODINE
1,8-dihydroxy-3-(hydroxymethyl)anthracene-9,10-dione
Rhabarberone
1,8-Dihydroxy-3-(hydroxymethyl)anthra-9,10-quinone
3-Hydroxymethylchrysazin
1,8-Dihydroxy-3-(hydroxymethyl)anthraquinone,3-Hydroxymethylchrysazine
1,8-Dihydroxy-3-(hydroxymethyl)-9,10-anthraquinone
Diacerein impurity B
9,10-Anthracenedione, 1,8-dihydroxy-3-(hydroxymethyl)-

Chemical & Physical Properties

[ Density]:
1.6±0.1 g/cm3

[ Boiling Point ]:
568.8±50.0 °C at 760 mmHg

[ Melting Point ]:
223-224°C

[ Molecular Formula ]:
C15H10O5

[ Molecular Weight ]:
270.237

[ Flash Point ]:
311.9±26.6 °C

[ Exact Mass ]:
270.052826

[ PSA ]:
94.83000

[ LogP ]:
3.38

[ Vapour Pressure ]:
0.0±1.6 mmHg at 25°C

[ Index of Refraction ]:
1.746

[ Storage condition ]:
2-8°C

[ Stability ]:
Hygroscopic

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CB6712200
CHEMICAL NAME :
Anthraquinone, 1,8-dihydroxy-3-hydroxymethyl-
CAS REGISTRY NUMBER :
481-72-1
BEILSTEIN REFERENCE NO. :
2059062
LAST UPDATED :
199612
DATA ITEMS CITED :
9
MOLECULAR FORMULA :
C15-H10-O5
MOLECULAR WEIGHT :
270.25
WISWESSER LINE NOTATION :
L C666 BV IVJ DQ F1Q NQ

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in mammalian somatic cells
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
10 mg/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 240,1,1990

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H315-H319-H335

[ Precautionary Statements ]:
P261-P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38:Irritating to eyes, respiratory system and skin .

[ Safety Phrases ]:
S26-S36

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
3

[ RTECS ]:
CB6712200

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Chrysophanic acid
  • (4,5-dihydroxy-9,10-dioxoanthracen-2-yl)methyl acetate
  • 3-(bromomethyl)-1,8-dihydroxy-9,10-Anthracenedione
  • Aloin
  • 4-Bromo-3-carboxy-1,8-dimethoxy-9,10-anthraquinone
  • 1-methoxycyclohexa-1,3-diene
  • ethyl 4-acetyloxy-6-chloro-5,8-dimethoxynaphthalene-2-carboxylate

DownStream

  • Rhein
  • Chrysophanic acid
  • (4,5-dihydroxy-9,10-dioxoanthracen-2-yl)methyl acetate
  • 2-METHYLANTHRACENE
  • 3-[[(2R,3R,4R,5S,6R)-3-amino-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,8-dihydroxyanthracene-9,10-dione
  • (4,5-diacetyloxy-9,10-dioxoanthracen-2-yl)methyl acetate
  • 3-Methoxyphthalic acid
  • 1-hydroxy-3-(hydroxymethyl)-8-methoxyanthracene-9,10-dione
  • 4,5-dimethoxy-9,10-dioxoanthracene-2-carboxylic acid
  • 3-(chloromethyl)-1,8-dihydroxyanthracene-9,10-dione

Articles

Correlation between reduction potentials and inhibitions of Epstein-Barr virus activation by anthraquinone derivatives.

Bioorg. Med. Chem. Lett. 18 , 4106-9, (2008)

As a continuation of studies using natural and synthetic products as cancer chemopreventive agents, we used cyclic voltammetry to examine the reduction-oxidation potentials of methylated emodin deriva...

In vitro inhibition of Streptococcus mutans biofilm formation on hydroxyapatite by subinhibitory concentrations of anthraquinones.

Antimicrob. Agents Chemother. 51 , 1541-4, (2007)

We report that certain anthraquinones (AQs) reduce Streptococcus mutans biofilm formation on hydroxyapatite at concentrations below the MIC. Although AQs are known to generate reactive oxygen species,...

High-affinity, non-nucleotide-derived competitive antagonists of platelet P2Y12 receptors.

J. Med. Chem. 52 , 3784-93, (2009)

Anthraquinone derivatives related to the moderately potent, nonselective P2Y(12) receptor antagonist reactive blue 2 (6) have been synthesized and optimized with respect to P2Y(12) receptor affinity. ...


More Articles

Related Compounds

  • Aloeemodin-triacetat
  • ALOEEMODIN,7-HYDROXY
  • Aloeemodin-8-monoglucoside
  • Aloeemodin-emodin-dianthron
  • Chrysophanol-aloeemodin-dianthron
  • Aloeemodin-ω-O-β-D-glucopyranoside
  • 5-Cyclopropoxy-4-methylpyridine-3-sulfonamide
  • tert-Butyl (R)-3-(2,6-difluorophenyl)piperazine-1-carboxylate
  • prop-2-enyl (5R,6S)-6-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyethyl]-7-oxo-3-propylsulfanyl-4-thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylate
  • 2-Bromo-6-(methylamino)phenol
  • N-[(3-bromophenyl)(cyano)methyl]-2-(4-difluoromethanesulfonylphenyl)acetamide
  • [2-Cyano-3-(2-methylpropoxy)phenyl]boronic acid
  • N-(4-Bromo-3-chlorophenyl)aminosulfonamide
  • Octahydro-1'H-spiro[1,3-dioxolane-2,6'-quinoline]
  • N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[3-(4-fluoro-3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]acetamide
  • 2-[3-(4-fluoro-3-methylphenyl)-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl]-N-[4-(propan-2-yl)phenyl]acetamide
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