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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:31668 - Hepronicate
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ChEBI Ontology
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ChEBI Name
Hepronicate
ChEBI ID
CHEBI:31668
Stars
This entity has been manually annotated by a third party.
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Formulae
C28H31N3O6
C28H31N3O6
Net Charge
0
Average Mass
505.563
Monoisotopic Mass
505.22129
InChI
InChI=1S/C28H31N3O6/c1-
2-
3-
4-
5-
12-
28(19-
35-
25(32)
22-
9-
6-
13-
29-
16-
22,20-
36-
26(33)
23-
10-
7-
14-
30-
17-
23)
21-
37-
27(34)
24-
11-
8-
15-
31-
18-
24/h6-
11,13-
18H,2-
5,12,19-
21H2,1H3
InChIKey
GUIBJJJLGSYNKE-UHFFFAOYSA-N
SMILES
C(COC(=O)C=1C=CC=NC1)(COC(=O)C=2C=CC=NC2)(COC(=O)C=3C=CC=NC3)CCCCCC
ChEBI Ontology
Outgoing
Hepronicate (
CHEBI:31668
)
is a
organic molecular entity (
CHEBI:50860
)
Synonyms
Sources
Hepronicate
KEGG COMPOUND
megrin
DrugCentral
Manual Xrefs
Databases
1359
DrugCentral
D01882
KEGG DRUG
View more database links
Registry Number
Type
Source
7237-81-2
CAS Registry Number
KEGG COMPOUND
Last Modified
22 February 2017