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English
Citreamicin eta
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
585.127110556
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₁H₂₃NO₁₁
0 references
canonical SMILES
O=C1C=2OC3=CC(OC)=C(OC)C=C3C(=O)C2C(=O)C=4C1=CC=C5C=C6C(C(=O)N7C(OC(=O)C7(C)CO)(C)C6)=C(O)C54
0 references
found in taxon
Micromonospora citrea
1 reference
stated in
Citreamicins, novel antibiotics from Micromonospora citrea: isolation, characterization, and structure determination.
Identifiers
InChI
InChI=1S/C31H23NO11/c1-30(11-33)29(39)43-31(2)10-13-7-12-5-6-14-21(19(12)25(36)20(13)28(38)32(30)31)26(37)22-23(34)15-8-17(40-3)18(41-4)9-16(15)42-27(22)24(14)35/h5-9,33,36H,10-11H2,1-4H3
0 references
InChIKey
LDQXZFAGJRSXAT-UHFFFAOYSA-N
0 references
CAS Registry Number
128969-88-0
0 references
PubChem CID
195593
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LDQXZFAGJRSXAT-UHFFFAOYSA-N
ChEBI ID
219515
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C31H23NO11/c1-30(11-33)29(39)43-31(2)10-13-7-12-5-6-14-21(19(12)25(36)20(13)28(38)32(30)31)26(37)22-23(34)15-8-17(40-3)18(41-4)9-16(15)42-27(22)24(14)35/h5-9,33,36H,10-11H2,1-4H3
UniChem compound ID
32028795
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50926261
1 reference
matched by identifier from
InChIKey
InChIKey
LDQXZFAGJRSXAT-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID301355077
0 references
Natural Product Atlas ID
NPA032693
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LDQXZFAGJRSXAT-UHFFFAOYSA-N
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