Shanghai Nianxing Industrial Co., Ltd
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Product Name: Agroclavine
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DC Chemicals Limited
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Product Name: AGROCLAVIN
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Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: Ergoline,8,9-didehydro-6,8-dimethyl-
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548-42-5

548-42-5 structure

548-42-5 structure

Name: AGROCLAVIN
Chemical Name: agroclavine
CAS Number: 548-42-5
Molecular Formula: C₁₆H₁₈N₂
Molecular Weight: 238.32800
Catalog: Signaling Pathways GPCR/G Protein Adrenergic Receptor
Create Date: 2018-05-07 08:00:00
Modify Date: 2024-01-05 18:26:38
Agroclavine is a natural, clavine type of ergot alkaloid. Agroclavine is a D1 dopamine receptor and α1-adrenoceptor agonist. Agroclavine also has anticancer and antimicrobial activities[1][2].

Name	agroclavine
Synonyms	8,9-didehydro-6,8-dimethyl-ergolin ERGOLINE,8,9-DIDEHYDRO-6,8-DIMETHYL Indolo[4,3-fg]quinoline, 4,6,6a,7,8,10a-hexahydro-7,9-dimethyl- 6,8-Dimethyl-8,9-didehydro-ergolin 6,8-dimethyl-8,9-didehydro-ergoline AGROCLAVINE 8,9-didehydro-6,8-dimethylergoline

Description	Agroclavine is a natural, clavine type of ergot alkaloid. Agroclavine is a D1 dopamine receptor and α1-adrenoceptor agonist. Agroclavine also has anticancer and antimicrobial activities[1][2].
Related Catalog	Research Areas >> Cancer Research Areas >> Infection Signaling Pathways >> GPCR/G Protein >> Dopamine Receptor Signaling Pathways >> GPCR/G Protein >> Adrenergic Receptor Signaling Pathways >> Neuronal Signaling >> Dopamine Receptor
Target	D1 Receptor α1-adrenergic receptor
References	[1]. Starec M, et al. Effect of agroclavine on NK activity in vivo under normal and stress conditions in rats. Physiol Res. 2001;50(5):513-9. [2]. Eich E, et al. Antimicrobial activity of clavines. Arzneimittelforschung. 1985;35(12):1760-2.

Density	1.161g/cm3
Boiling Point	422.5ºC at 760mmHg
Molecular Formula	C₁₆H₁₈N₂
Molecular Weight	238.32800
Flash Point	209.3ºC
Exact Mass	238.14700
PSA	19.03000
LogP	3.00580
Index of Refraction	1.653

CHEMICAL IDENTIFICATION

RTECS NUMBER :: KE6325000

CHEMICAL NAME :: Ergoline, 8,9-didehydro-6,8-dimethyl-

CAS REGISTRY NUMBER :: 548-42-5

BEILSTEIN REFERENCE NO. :: 0024966

LAST UPDATED :: 199709

DATA ITEMS CITED :: 5

MOLECULAR FORMULA :: C16-H18-N2

MOLECULAR WEIGHT :: 238.36

WISWESSER LINE NOTATION :: T C6656 1A P GN LM DUTT&&J E1 G1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 25 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 :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 25500 ug/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Behavioral - excitement Lungs, Thorax, or Respiration - cyanosis

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

DOSE :: 50 mg/kg

SEX/DURATION :: female 1-5 day(s) after conception

TOXIC EFFECTS :: Reproductive - Fertility - female fertility index (e.g. # females pregnant per # sperm positive females; # females pregnant per # females mated)

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

DOSE :: 20 mg/kg

SEX/DURATION :: female 3-4 day(s) after conception

TOXIC EFFECTS :: Reproductive - Fertility - other measures of fertility

MUTATION DATA

TYPE OF TEST :: Mutation in microorganisms

TEST SYSTEM :: Bacteria - Salmonella typhimurium

DOSE/DURATION :: 2 umol/plate

REFERENCE :: CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut Sts., Philadelphia, PA 19106) V.1- 1941- Volume(issue)/page/year: 47,1811,1987

HS Code	2933990090

Precursor 0
DownStream 1
1935-33-7

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%