Dihydro α-Ergocryptine

Modify Date: 2025-08-26 16:55:00

Dihydro α-Ergocryptine Structure
Dihydro α-Ergocryptine structure
Common Name Dihydro α-Ergocryptine
CAS Number 25447-66-9 Molecular Weight 577.71400
Density 1.36g/cm3 Boiling Point 848.7ºC at 760 mmHg
Molecular Formula C32H43N5O5 Melting Point N/A
MSDS N/A Flash Point 467.1ºC

 Names

Name dihydro-α-ergocryptine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.36g/cm3
Boiling Point 848.7ºC at 760 mmHg
Molecular Formula C32H43N5O5
Molecular Weight 577.71400
Flash Point 467.1ºC
Exact Mass 577.32600
PSA 121.70000
LogP 3.17460
Vapour Pressure 1.26E-30mmHg at 25°C
Index of Refraction 1.667
InChIKey PBUNVLRHZGSROC-VTIMJTGVSA-N
SMILES CC(C)CC1C(=O)N2CCCC2C2(O)OC(NC(=O)C3CC4c5cccc6[nH]cc(c56)CC4N(C)C3)(C(C)C)C(=O)N12

 Dihydro α-ErgocryptineBioassay

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Name: Binding affinity towards human GABRA1 in an in vitro assay with cellular components m...
Source: ChEMBL
Target: Gamma-aminobutyric acid receptor subunit gamma-2
External Id: CHEMBL5291799
Name: qHTS assay to identify small molecule antagonists of the androgen receptor (AR) signa...
Source: 824
Target: AR protein [Homo sapiens]
External Id: MDAN535
Name: Binding affinity towards human ESR1 in an in vitro cell free assay (CRO assay) measur...
Source: ChEMBL
Target: Estrogen receptor
External Id: CHEMBL5291792
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
Name: Compound was evaluated for inhibition of human F2 in an in vitro cell free assay meas...
Source: ChEMBL
Target: Prothrombin
External Id: CHEMBL5291794
Name: Cytotoxicity counterscreen for inhibitors of SARS-CoV-2 cell entry
Source: NCGC
Target: N/A
External Id: TRND-SARS-CoV-2-cytotox-48hr
Name: qHTS assay for small molecules that induce genotoxicity in human embryonic kidney cel...
Source: 824
Target: RecName: Full=ATPase family AAA domain-containing protein 5; AltName: Full=Chromosome fragility-associated gene 1 protein
External Id: ELG271
Name: Primary qHTS to identify inhibitors of SARS-CoV-2 cell entry
Source: NCGC
External Id: TRND-SARS-CoV-2-PP
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 Synonyms

Dihydroergokryptine
Dihydroergocryptine
EINECS 246-993-6
Dihydroergocriptine
dihydro-alpha-ergocryptine
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