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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:6360 - Lactupicrin
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ChEBI Ontology
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ChEBI Name
Lactupicrin
ChEBI ID
CHEBI:6360
Stars
This entity has been manually annotated by a third party.
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Formula
C23H22O7
Net Charge
0
Average Mass
410.417
Monoisotopic Mass
410.13655
InChI
InChI=1S/C23H22O7/c1-
11-
7-
17(29-
18(27)
8-
13-
3-
5-
15(25)
6-
4-
13)
20-
12(2)
23(28)
30-
22(20)
21-
14(10-
24)
9-
16(26)
19(11)
21/h3-
6,9,17,20-
22,24-
25H,2,7-
8,10H2,1H3/t17-
,20+,21-
,22-
/m0/s1
InChIKey
UMVSOHBRAQTGQI-XGARDCMYSA-N
SMILES
CC1=C2[C@@H]([C@H]3OC(=O)C(=C)[C@@H]3[C@H](C1)OC(=O)Cc1ccc(O)cc1)C(CO)=CC2=O
ChEBI Ontology
Outgoing
Lactupicrin (
CHEBI:6360
)
is a
sesquiterpene lactone (
CHEBI:37667
)
Synonym
Source
Lactupicrin
KEGG COMPOUND
Manual Xrefs
Databases
C00003312
KNApSAcK
C09490
KEGG COMPOUND
View more database links
Registry Number
Type
Source
65725-11-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014