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Neolymphostin B
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyrrolo[4,3,2-de]quinoline alkaloid
0 references
mass
324.122240372
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₆N₄O₃
0 references
canonical SMILES
CCC(=O)Nc1cc(=N)c2ncc3cc(C(=O)C=COC)[nH]c1c32
0 references
found in taxon
Salinispora arenicola
1 reference
stated in
Discovery and assembly-line biosynthesis of the lymphostin pyrroloquinoline alkaloid family of mTOR inhibitors in Salinispora bacteria.
Identifiers
InChI
InChI=1S/C17H16N4O3/c1-3-14(23)20-12-7-10(18)16-15-9(8-19-16)6-11(21-17(12)15)13(22)4-5-24-2/h4-8,18,21H,3H2,1-2H3,(H,20,23)
0 references
InChIKey
XYNRTRHNQGKROF-UHFFFAOYSA-N
0 references
PubChem CID
139588266
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XYNRTRHNQGKROF-UHFFFAOYSA-N
ChEBI ID
210505
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H16N4O3/c1-3-14(23)20-12-7-10(18)16-15-9(8-19-16)6-11(21-17(12)15)13(22)4-5-24-2/h4-8,18,21H,3H2,1-2H3,(H,20,23)
UniChem compound ID
170911286
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA018570
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XYNRTRHNQGKROF-UHFFFAOYSA-N
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