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ChEBI
> Main
CHEBI:1959 - 5'-Demethoxydeoxypodophyllotoxin
Main
ChEBI Ontology
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ChEBI Name
5'-Demethoxydeoxypodophyllotoxin
ChEBI ID
CHEBI:1959
Stars
This entity has been manually annotated by a third party.
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Formula
C21H20O6
Net Charge
0
Average Mass
368.381
Monoisotopic Mass
368.12599
InChI
InChI=1S/C21H20O6/c1-
23-
15-
4-
3-
11(6-
16(15)
24-
2)
19-
14-
8-
18-
17(26-
10-
27-
18)
7-
12(14)
5-
13-
9-
25-
21(22)
20(13)
19/h3-
4,6-
8,13,19-
20H,5,9-
10H2,1-
2H3/t13-
,19+,20-
/m0/s1
InChIKey
MKWAWTRNIPHOLB-SVIJTADQSA-N
SMILES
COc1ccc(cc1OC)[C@H]1[C@@H]2[C@H](COC2=O)Cc2cc3OCOc3cc12
ChEBI Ontology
Outgoing
5'-Demethoxydeoxypodophyllotoxin (
CHEBI:1959
)
is a
lactone (
CHEBI:25000
)
5'-Demethoxydeoxypodophyllotoxin (
CHEBI:1959
)
is a
lignan (
CHEBI:25036
)
Synonym
Source
5'-Demethoxydeoxypodophyllotoxin
KEGG COMPOUND
Manual Xrefs
Databases
C00002593
KNApSAcK
C10551
KEGG COMPOUND
View more database links
Registry Number
Type
Source
63700-40-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014