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Substance Name: Carbocromen [INN]
RN: 804-10-4
UNII: R0C9NIE5JJ
InChIKey: KLOIYEQEVSIOOO-UHFFFAOYSA-N

Note

  • A coronary vasodilator agent.

Molecular Formula

  • C20-H27-N-O5

Molecular Weight

  • 361.435
 

Classification Codes

  • Cardiovascular Agents
  • Drug / Therapeutic Agent
  • Vasodilator Agents
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Names and Synonyms

Results Name

  • Carbocromen [INN]

Name of Substance

  • Carbocromen [INN]
  • Chromonar

MeSH Heading

  • Chromonar

Synonyms

  • 5-18-12-00048 (Beilstein Handbook Reference)
  • BRN 1691147
  • Carbochromen
  • Carbochromene
  • Carbocromen
  • Carbocromene
  • Carbocromene [INN-French]
  • Carbocromeno
  • Carbocromeno [INN-Spanish]
  • Carbocromenum
  • Carbocromenum [INN-Latin]
  • Chromonar
  • EINECS 212-356-6
  • UNII-R0C9NIE5JJ

Systematic Names

  • Acetic acid, ((3-(2-(diethylamino)ethyl)-4-methyl-2-oxo-2H-1-benzopyran-7-yl)oxy)-, ethyl ester
  • Carbocromen

Registry Numbers

CAS Registry Number

  • 804-10-4

FDA UNII

  • R0C9NIE5JJ

Related Registry Number

  • 655-35-6 (hydrochloride)

System Generated Number

  • 0000804104

Structure Descriptors

InChI

1S/C20H27NO5/c1-5-21(6-2)11-10-17-14(4)16-9-8-15(12-18(16)26-20(17)23)25-13-19(22)24-7-3/h8-9,12H,5-7,10-11,13H2,1-4H3

InChIKey

KLOIYEQEVSIOOO-UHFFFAOYSA-N

Smiles

O(CC(OCC)=O)c1cc2c(c(c(CCN(CC)CC)c(o2)=O)C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD50 intravenous 35500ug/kg (35.5mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 7, Pg. 1494, 1965.
dog LD50 oral 6300mg/kg (6300mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 7, Pg. 1494, 1965.
mouse LD50 intraperitoneal 528mg/kg (528mg/kg)   Yakkyoku. Pharmacy. Vol. 24, Pg. 431, 1973.
mouse LD50 intravenous 35500ug/kg (35.5mg/kg)   Drugs in Japan Vol. 6, Pg. 189, 1982.
mouse LD50 oral 6300mg/kg (6300mg/kg)   Drugs in Japan Vol. 6, Pg. 189, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.400 (none)   EST
Atmospheric OH Rate Constant 1.58E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.