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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:32002 - Pimilprost
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ChEBI Ontology
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ChEBI Name
Pimilprost
ChEBI ID
CHEBI:32002
Stars
This entity has been manually annotated by a third party.
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Formulae
C23H40O5
C23H40O5
Net Charge
0
Average Mass
396.562
Monoisotopic Mass
396.28757
InChI
InChI=1S/C23H40O5/c1-
4-
5-
6-
16(2)
11-
19(24)
7-
8-
20-
21-
13-
17(12-
18(21)
14-
22(20)
25)
9-
10-
28-
15-
23(26)
27-
3/h7-
8,16-
22,24-
25H,4-
6,9-
15H2,1-
3H3/b8-
7+/t16-
,17+,18-
,19+,20+,21-
,22+/m0/s1
InChIKey
SLDLSMFNGFIPNI-RXYUHBJGSA-N
SMILES
C1[C@H]([C@@H]([C@@H]2[C@H]1C[C@H](C2)CCOCC(OC)=O)/C=C/[C@H](C[C@H](CCCC)C)O)O
ChEBI Ontology
Outgoing
Pimilprost (
CHEBI:32002
)
is a
monoterpenoid (
CHEBI:25409
)
Synonym
Source
Pimilprost
KEGG COMPOUND
Manual Xref
Database
D01188
KEGG DRUG
View more database links
Registry Number
Type
Source
139403-31-9
CAS Registry Number
KEGG COMPOUND
Last Modified
06 March 2017