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Epoxyquinomicin D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-chloro-2-hydroxy-N-[2-hydroxy-6-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]benzenecarboximidic acid
1 reference
based on heuristic
inferred from SMILES
mass
325.035314784
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₄H₁₂ClNO₆
0 references
canonical SMILES
O=C(NC1=CC(=O)C2(CO)OC2C1O)c1cccc(Cl)c1O
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isomeric SMILES
C1=CC(=C(C(=C1)Cl)O)C(=O)NC2=CC(=O)[C@]3([C@@H]([C@H]2O)O3)CO
0 references
found in taxon
Amycolatopsis sulphurea
1 reference
stated in
Epoxyquinomicins A, B, C and D, new antibiotics from Amycolatopsis. I. Taxonomy, fermentation, isolation and antimicrobial activities.
Amycolatopsis
1 reference
stated in
Epoxyquinomicins A, B, C and D, new antibiotics from Amycolatopsis. III. Physico-chemical properties and structure determination
Identifiers
InChI
InChI=1S/C14H12ClNO6/c15-7-3-1-2-6(10(7)19)13(21)16-8-4-9(18)14(5-17)12(22-14)11(8)20/h1-4,11-12,17,19-20H,5H2,(H,16,21)/t11-,12+,14-/m0/s1
0 references
InChIKey
CQWDZNQKJPNNJB-SCRDCRAPSA-N
0 references
CAS Registry Number
200496-86-2
0 references
PubChem CID
3075749
1 reference
matched by identifier from
InChIKey
InChIKey
CQWDZNQKJPNNJB-SCRDCRAPSA-N
ChEBI ID
213453
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C14H12ClNO6/c15-7-3-1-2-6(10(7)19)13(21)16-8-4-9(18)14(5-17)12(22-14)11(8)20/h1-4,11-12,17,19-20H,5H2,(H,16,21)/t11-,12+,14-/m0/s1
UniChem compound ID
32385140
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50942062
1 reference
matched by identifier from
InChIKey
InChIKey
CQWDZNQKJPNNJB-SCRDCRAPSA-N
DSSTOX compound identifier
DTXCID601370480
0 references
Natural Product Atlas ID
NPA010345
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CQWDZNQKJPNNJB-SCRDCRAPSA-N
Probes And Drugs ID
PD128844
0 references
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