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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:8522 - Prostalidin A
Main
ChEBI Ontology
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ChEBI Name
Prostalidin A
ChEBI ID
CHEBI:8522
Stars
This entity has been manually annotated by a third party.
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Formula
C21H14O8
Net Charge
0
Average Mass
394.332
Monoisotopic Mass
394.06887
InChI
InChI=1S/C21H14O8/c1-
24-
19-
10-
2-
11-
13(6-
25-
21(11)
23)
18(9(10)
3-
17-
20(19)
29-
8-
28-
17)
12-
4-
15-
16(5-
14(12)
22)
27-
7-
26-
15/h2-
5,22H,6-
8H2,1H3
InChIKey
SPDGJRPFXFRCMO-UHFFFAOYSA-N
SMILES
COc1c2OCOc2cc2c(c3COC(=O)c3cc12)-c1cc2OCOc2cc1O
ChEBI Ontology
Outgoing
Prostalidin A (
CHEBI:8522
)
is a
lignan (
CHEBI:25036
)
Synonym
Source
Prostalidin A
KEGG COMPOUND
Manual Xrefs
Databases
C00000727
KNApSAcK
C10877
KEGG COMPOUND
View more database links
Registry Number
Type
Source
73461-17-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014