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CHEBI:68317 - 1-O-acetylbulbisine Trifluoroacetic acid
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ChEBI Name
1-O-acetylbulbisine Trifluoroacetic acid
ChEBI ID
CHEBI:68317
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
C21H24F3NO8
Net Charge
0
Average Mass
475.41240
Monoisotopic Mass
475.14540
InChI
InChI=1S/C19H23NO6.C2HF3O2/c1-
10(21)
26-
18-
13(22)
3-
4-
15-
19(18)
5-
6-
20(15)
8-
11-
12(19)
7-
14-
17(16(11)
23-
2)
25-
9-
24-
14;3-
2(4,5)
1(6)
7/h7,13,15,18,22H,3-
6,8-
9H2,1-
2H3;(H,6,7)
/t13-
,15+,18-
,19-
;/m0./s1
InChIKey
PHKPVEVVOAOZGO-QCAFIXIBSA-N
SMILES
OC(=O)C(F)(F)F.[H][C@@]12CC[C@H](O)[C@H](OC(C)=O)[C@]11CCN2Cc2c(OC)c3OCOc3cc12
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
1-O-acetylbulbisine Trifluoroacetic acid (
CHEBI:68317
)
has role
metabolite (
CHEBI:25212
)
1-O-acetylbulbisine Trifluoroacetic acid (
CHEBI:68317
)
is a
organic molecular entity (
CHEBI:50860
)
Citation
Type
Source
21314165
PubMed citation
Europe PMC