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iron*
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InChI=1S/CH4O/c1-2/h2H,1H3
,
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ChEBI
> Main
CHEBI:80084 - Antibiotic TA
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ChEBI Ontology
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ChEBI Name
Antibiotic TA
ChEBI ID
CHEBI:80084
Stars
This entity has been manually annotated by a third party.
Supplier Information
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SDF
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Formula
C35H61NO8
Net Charge
0
Average Mass
623.86070
Monoisotopic Mass
623.43972
InChI
InChI=1S/C35H61NO8/c1-
6-
12-
33-
34(41)
36-
23-
30(38)
22-
32(40)
31(39)
20-
19-
28(24-
43-
5)
16-
10-
14-
27(7-
2)
15-
11-
18-
29(37)
17-
9-
8-
13-
25(3)
21-
26(4)
35(42)
44-
33/h10,14,16,25-
27,30-
33,38-
40H,6-
9,11-
13,15,17-
24H2,1-
5H3,(H,36,41)
/b14-
10+,28-
16-
InChIKey
VQWNGCSUNKJFLW-ACPVBGRSSA-N
SMILES
CCCC1OC(=O)C(C)CC(C)CCCCC(=O)CCCC(CC)\C=C\C=C(COC)\CCC(O)C(O)CC(O)CNC1=O
ChEBI Ontology
Outgoing
Antibiotic TA (
CHEBI:80084
)
is a
lactam (
CHEBI:24995
)
Antibiotic TA (
CHEBI:80084
)
is a
macrolide (
CHEBI:25106
)
Manual Xrefs
Databases
C00018471
KNApSAcK
C15756
KEGG COMPOUND
View more database links
Registry Number
Type
Source
60616-99-1
CAS Registry Number
KEGG COMPOUND