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InChI=1S/CH4O/c1-2/h2H,1H3
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CHEBI:3627 - Chlorohyssopifolin A
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ChEBI Ontology
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ChEBI Name
Chlorohyssopifolin A
ChEBI ID
CHEBI:3627
Stars
This entity has been manually annotated by a third party.
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Formula
C19H24Cl2O7
Net Charge
0
Average Mass
435.296
Monoisotopic Mass
434.08991
InChI
InChI=1S/C19H24Cl2O7/c1-
8-
4-
11(27-
17(24)
18(3,25)
6-
20)
13-
9(2)
16(23)
28-
15(13)
14-
10(8)
5-
12(22)
19(14,26)
7-
21/h10-
15,22,25-
26H,1-
2,4-
7H2,3H3/t10-
,11-
,12+,13+,14-
,15-
,18+,19+/m0/s1
InChIKey
NUVAJKJDTZTFLK-KPSOQAITSA-N
SMILES
C[C@@](O)(CCl)C(=O)O[C@H]1CC(=C)[C@@H]2C[C@@H](O)[C@](O)(CCl)[C@@H]2[C@H]2OC(=O)C(=C)[C@H]12
ChEBI Ontology
Outgoing
Chlorohyssopifolin A (
CHEBI:3627
)
is a
sesquiterpene lactone (
CHEBI:37667
)
Synonym
Source
Chlorohyssopifolin A
KEGG COMPOUND
Manual Xrefs
Databases
C00003230
KNApSAcK
C09359
KEGG COMPOUND
View more database links
Registry Number
Type
Source
37006-36-3
CAS Registry Number
KEGG COMPOUND
Last Modified
28 July 2014