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ChEBI
> Main
CHEBI:77352 - methymycin(1+)
Main
ChEBI Ontology
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ChEBI Name
methymycin(1+)
ChEBI ID
CHEBI:77352
Definition
An organic cation that is the conjugate acid of methymycin, obtained by protonation of the tertiary amino group; major species at pH 7.3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
KAX
Supplier Information
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Formula
C25H44NO7
Net Charge
+1
Average Mass
470.61880
Monoisotopic Mass
470.31123
InChI
InChI=1S/C25H43NO7/c1-
9-
20-
25(6,30)
11-
10-
19(27)
14(2)
12-
15(3)
22(17(5)
23(29)
32-
20)
33-
24-
21(28)
18(26(7)
8)
13-
16(4)
31-
24/h10-
11,14-
18,20-
22,24,28,30H,9,12-
13H2,1-
8H3/p+1/b11-
10+/t14-
,15+,16-
,17-
,18+,20-
,21-
,22+,24+,25+/m1/s1
InChIKey
HUKYPYXOBINMND-HYUJHOPRSA-O
SMILES
CC[C@H]
1OC(=O)
[C@H]
(C)
[C@@H]
(O[C@@H]
2O[C@H]
(C)
C[C@@H]
([C@H]
2O)
[NH+]
(C)
C)
[C@@H]
(C)
C[C@@H]
(C)
C(=O)
\C=C\[C@]
1(C)
O
ChEBI Ontology
Outgoing
methymycin(1+) (
CHEBI:77352
)
is a
ammonium ion derivative (
CHEBI:35274
)
methymycin(1+) (
CHEBI:77352
)
is a
organic cation (
CHEBI:25697
)
methymycin(1+) (
CHEBI:77352
)
is conjugate acid of
methymycin (
CHEBI:29630
)
Incoming
methymycin (
CHEBI:29630
)
is conjugate base of
methymycin(1+) (
CHEBI:77352
)
IUPAC Name
(3
R
,4
S
,5
S
,7
R
,9
E
,11
S
,12
R
)-
12-
ethyl-
11-
hydroxy-
3,5,7,11-
tetramethyl-
2,8-
dioxooxacyclododec-
9-
en-
4-
yl 3,4,6-
trideoxy-
3-
(dimethylazaniumyl)-
β-
D
-
xylo
-
hexopyranoside
Synonym
Source
methymycin
UniProt
Manual Xref
Database
CPD-13832
MetaCyc
View more database links
Citation
Type
Source
9831532
PubMed citation
SUBMITTER
Last Modified
11 March 2014