STIGMATELLIN

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Names

[ CAS No. ]:
91682-96-1

[ Name ]:
STIGMATELLIN

[Synonym ]:
Stigmatellin A

Chemical & Physical Properties

[ Density]:
1.081g/cm3

[ Boiling Point ]:
635ºC at 760mmHg

[ Melting Point ]:
82-89ºC /Technical grade 82-90% purity/

[ Molecular Formula ]:
C30H42O7

[ Molecular Weight ]:
514.65000

[ Flash Point ]:
198.1ºC

[ Exact Mass ]:
514.29300

[ PSA ]:
87.36000

[ LogP ]:
6.13760

[ Index of Refraction ]:
1.527

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GB7972000
CHEMICAL NAME :
Chromone, 5,7-dimethoxy-2-(4,6-dimethoxy-3,5,11-trimethyl-7,9,1 1-tridecatrienyl)-8-h ydroxy- 3-methyl-, (E,E,E)-
CAS REGISTRY NUMBER :
91682-96-1
LAST UPDATED :
199712
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C30-H42-O7
MOLECULAR WEIGHT :
514.72

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
30 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
Mutation test systems - not otherwise specified
TEST SYSTEM :
Yeast - Saccharomyces cerevisiae
DOSE/DURATION :
3300 ug/L
REFERENCE :
JANTAJ Journal of Antibiotics. (Japan Antibiotics Research Assoc., 2-20-8 Kamiosaki, Shinagawa-ku, Tokyo, 141, Japan) V.2-5, 1948-52; V.21- 1968- Volume(issue)/page/year: 37,454,1984

Safety Information

[ Hazard Codes ]:
T: Toxic;

[ Risk Phrases ]:
25

[ RIDADR ]:
UN 2811 6.1/PG 2

[ Packaging Group ]:
II

[ Hazard Class ]:
6.1(a)

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • [(2E,4E)-4-Methyl-2,4-hexadienyl]phosphonic Acid Diethyl Ester
  • (2R,3S,4S,5S)-7-[8-hydroxy-5,7-dimethoxy-3-methyl-4-oxo-4H-2-chromenyl]-2,4-dimethoxy-3,5-dimethylheptanal
  • 1-(2,3-Dihydroxy-4,6-dimethoxyphenyl)-1-propanone
  • 3,5-Dimethoxyphenol
  • Gallic acid
  • Methyl gallate
  • 1-[2-Hydroxy-4,6-dimethoxy-3-(1-oxopropoxy)phenyl]-1-propanone
  • 1-[2-Hydroxy-4,6-dimethoxy-3-(MethoxyMethoxy)phenyl]-1-propanone
  • (4S,5S,6S,7R)-5,7-Dimethoxy-4,6-dimethyl-8-(phenylmethoxy)-1-octanol
  • (4S,5S,6S,7R)-5,7-Dimethoxy-4,6-dimethyl-8-(phenylmethoxy)-octanoic Acid

DownStream

Related Compounds

  • Stigmatellin-A-methylether
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide
  • N-[3-(Aminooxy)propyl]-N-butyl-1-butanamine