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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:6808 - Methallenestril
Main
ChEBI Ontology
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ChEBI Name
Methallenestril
ChEBI ID
CHEBI:6808
Stars
This entity has been manually annotated by a third party.
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Formula
C18H22O3
Net Charge
0
Average Mass
286.366
Monoisotopic Mass
286.15689
InChI
InChI=1S/C18H22O3/c1-
5-
16(18(2,3)
17(19)
20)
14-
7-
6-
13-
11-
15(21-
4)
9-
8-
12(13)
10-
14/h6-
11,16H,5H2,1-
4H3,(H,19,20)
InChIKey
KHLJKRBMZVNZOC-UHFFFAOYSA-N
SMILES
CCC(c1ccc2cc(OC)ccc2c1)C(C)(C)C(O)=O
ChEBI Ontology
Outgoing
Methallenestril (
CHEBI:6808
)
is a
naphthalenes (
CHEBI:25477
)
Synonyms
Sources
Methallenestril
KEGG COMPOUND
methallenestrol
DrugCentral
novestrine
DrugCentral
vallestril
DrugCentral
Manual Xrefs
Databases
1731
DrugCentral
C07621
KEGG COMPOUND
View more database links
Registry Number
Type
Source
517-18-0
CAS Registry Number
KEGG COMPOUND
Last Modified
22 February 2017