Home
Random
Nearby
Log in
Settings
Donate
About Wikidata
Disclaimers
Search
(Q82956033)
Watch
English
(2-Chloroergolin-8-yl)acetonitrile
chemical compound
In more languages
edit
Statements
instance of
group of stereoisomers
0 references
subclass of
2-[(9S)-5-chloro-4,6,6a,7,8,9,10,10a-octahydroindolo[4,3-fg]quinolin-9-yl]acetonitrile
1 reference
based on heuristic
inferred from SMILES
mass
285.103275192
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₆ClN₃
0 references
canonical SMILES
N#CCC1CNC2CC3=C(Cl)NC4=CC=CC(=C43)C2C1
0 references
isomeric SMILES
N#CC[C@H]1CN[C@@H]2Cc3c(Cl)[nH]c4cccc(c34)C2C1
0 references
found in taxon
Streptomyces platensis
1 reference
stated in
N-demethylation of lergotrile by Streptomyces platensis
Identifiers
InChI
InChI=1S/C16H16ClN3/c17-16-12-7-14-11(6-9(4-5-18)8-19-14)10-2-1-3-13(20-16)15(10)12/h1-3,9,11,14,19-20H,4,6-8H2/t9-,11?,14-/m1/s1
0 references
InChIKey
QSRIXAFISHOVGA-FVNFBUEFSA-N
0 references
CAS Registry Number
56867-81-3
0 references
PubChem CID
194029
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
43786839
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID00972293
0 references
DSSTOX compound identifier
DTXCID701399768
0 references
Sitelinks
Wikipedia
(0 entries)
edit
Wikibooks
(0 entries)
edit
Wikinews
(0 entries)
edit
Wikiquote
(0 entries)
edit
Wikisource
(0 entries)
edit
Wikiversity
(0 entries)
edit
Wikivoyage
(0 entries)
edit
Wiktionary
(0 entries)
edit
Multilingual sites
(0 entries)
edit