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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:4583 - Dihydrosamidin
Main
ChEBI Ontology
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ChEBI Name
Dihydrosamidin
ChEBI ID
CHEBI:4583
Stars
This entity has been manually annotated by a third party.
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Formulae
C21H24O7
C21H24O7
Net Charge
0
Average Mass
388.412
Monoisotopic Mass
388.15220
InChI
InChI=1S/C21H24O7/c1-
11(2)
10-
16(24)
27-
20-
19(25-
12(3)
22)
17-
14(28-
21(20,4)
5)
8-
6-
13-
7-
9-
15(23)
26-
18(13)
17/h6-
9,11,19-
20H,10H2,1-
5H3/t19-
,20-
/m1/s1
InChIKey
ALKTVPFKDYZFGA-WOJBJXKFSA-N
SMILES
CC(C)CC(=O)O[C@@H]1[C@H](OC(C)=O)c2c(OC1(C)C)ccc1ccc(=O)oc21
ChEBI Ontology
Outgoing
Dihydrosamidin (
CHEBI:4583
)
is a
coumarins (
CHEBI:23403
)
Synonym
Source
Dihydrosamidin
KEGG COMPOUND
Manual Xrefs
Databases
C00002468
KNApSAcK
C09260
KEGG COMPOUND
LSM-3429
LINCS
View more database links
Registry Number
Type
Source
6005-18-1
CAS Registry Number
KEGG COMPOUND
Last Modified
25 February 2016