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(Q82912473)
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English
(6-Amino-1-butyl-8a-methoxy-5-methyl-4,7-dioxo-1,1a,2,4,7,8,8a,8b-octahydroazireno[2',3':3,4]pyrrolo[1,2-a]indol-8-yl)methyl hydrogen carbonimidate
group of stereoisomers with the chemical formula C₁₉H₂₆N₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
390.19031993199997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₂₆N₄O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCN1C2CN3C4=C(C(=O)C(N)=C(C)C4=O)C(COC(=N)O)C3(OC)C21
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCN1C2CN3C4=C(C(=O)C(N)=C(C)C4=O)[C@@H](COC(N)=O)[C@@]3(OC)C21
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C19H26N4O5/c1-4-5-6-22-11-7-23-14-12(16(25)13(20)9(2)15(14)24)10(8-28-18(21)26)19(23,27-3)17(11)22/h10-11,17H,4-8,20H2,1-3H3,(H2,21,26)/t10-,11?,17?,19-,22?/m1/s1
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InChIKey
NYDNHNDLODNBRO-WZZNODGGSA-N
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CAS Registry Number
16032-73-8
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PubChem CID
27646
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
48872386
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60936275
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DSSTOX compound identifier
DTXCID801364887
0 references
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