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> Main
CHEBI:68319 - 8-O-demethyloxomaritidine Trifluoroacetic acid
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ChEBI Ontology
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ChEBI Name
8-O-demethyloxomaritidine Trifluoroacetic acid
ChEBI ID
CHEBI:68319
Definition
A natural product found in
Crinum asiaticum
var.
sinicum
.
Stars
This entity has been manually annotated by a third party.
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Formula
C18H18F3NO5
Net Charge
0
Average Mass
385.33440
Monoisotopic Mass
385.11371
InChI
InChI=1S/C16H17NO3.C2HF3O2/c1-
20-
14-
8-
12-
10(6-
13(14)
19)
9-
17-
5-
4-
16(12)
3-
2-
11(18)
7-
15(16)
17;3-
2(4,5)
1(6)
7/h2-
3,6,8,15,19H,4-
5,7,9H2,1H3;(H,6,7)
/t15-
,16-
;/m0./s1
InChIKey
BNFVRWLADFLNAL-MOGJOVFKSA-N
SMILES
OC(=O)C(F)(F)F.[H][C@]12CC(=O)C=C[C@@]11CCN2Cc2cc(O)c(OC)cc12
Metabolite of Species
Details
Crinum asiaticum
var.
sinicum
(NCBI:txid223245)
Found in leaf
(BTO:0000713)
. 95% ethanolic extract of dried, powdered leaves See:
PubMed
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
8-O-demethyloxomaritidine Trifluoroacetic acid (
CHEBI:68319
)
has role
metabolite (
CHEBI:25212
)
8-O-demethyloxomaritidine Trifluoroacetic acid (
CHEBI:68319
)
is a
organic molecular entity (
CHEBI:50860
)
Synonym
Source
(1R,10S)-
5-
Hydroxy-
4-
methoxy-
9-
azatetracyclo[7.5.2.0(1,10).0(2,7)]hexadeca-
2,4,6,13-
tetraen-
12-
one Trifluoroacetic acid
ChEBI
Citation
Type
Source
21314165
PubMed citation
Europe PMC