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(Q82901924)
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English
(6-Amino-1-ethyl-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 C₁₇H₂₂N₄O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
362.15901980399997
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₂N₄O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCN1C2CN3C4=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
CCN1C2CN3C4=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/C17H22N4O5/c1-4-20-9-5-21-12-10(14(23)11(18)7(2)13(12)22)8(6-26-16(19)24)17(21,25-3)15(9)20/h8-9,15H,4-6,18H2,1-3H3,(H2,19,24)/t8-,9?,15?,17-,20?/m1/s1
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InChIKey
BLRIYTYGXGCSHE-QIXFNWECSA-N
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CAS Registry Number
13164-60-8
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PubChem CID
25748
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
66440434
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60927300
0 references
DSSTOX compound identifier
DTXCID501356095
0 references
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