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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:9647 - Trachelogenin
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ChEBI Ontology
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ChEBI Name
Trachelogenin
ChEBI ID
CHEBI:9647
Stars
This entity has been manually annotated by a third party.
Supplier Information
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Formula
C21H24O7
Net Charge
0
Average Mass
388.412
Monoisotopic Mass
388.15220
InChI
InChI=1S/C21H24O7/c1-
25-
17-
7-
5-
13(9-
19(17)
27-
3)
8-
15-
12-
28-
20(23)
21(15,24)
11-
14-
4-
6-
16(22)
18(10-
14)
26-
2/h4-
7,9-
10,15,22,24H,8,11-
12H2,1-
3H3/t15-
,21-
/m0/s1
InChIKey
YFVZKLQNMNKWSB-BTYIYWSLSA-N
SMILES
COc1cc(C[C@]2(O)[C@@H](Cc3ccc(OC)c(OC)c3)COC2=O)ccc1O
ChEBI Ontology
Outgoing
Trachelogenin (
CHEBI:9647
)
is a
lignan (
CHEBI:25036
)
Synonyms
Sources
(-)-Trachelogenin
KEGG COMPOUND
Trachelogenin
KEGG COMPOUND
Manual Xrefs
Databases
C00000600
KNApSAcK
C10891
KEGG COMPOUND
View more database links
Registry Number
Type
Source
34209-69-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014