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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:16976 - hygromycin B
Main
ChEBI Ontology
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ChEBI Name
hygromycin B
ChEBI ID
CHEBI:16976
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:14426, CHEBI:43202, CHEBI:5821, CHEBI:24752
Supplier Information
Download
Molfile
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Molfile
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Formula
C20H37N3O13
Net Charge
0
Average Mass
527.52010
Monoisotopic Mass
527.23264
InChI
InChI=1S/C20H37N3O13/c1-
23-
7-
2-
5(21)
9(26)
15(10(7)
27)
33-
19-
17-
16(11(28)
8(4-
25)
32-
19)
35-
20(36-
17)
18(31)
13(30)
12(29)
14(34-
20)
6(22)
3-
24/h5-
19,23-
31H,2-
4,21-
22H2,1H3/t5-
,6?,7+,8-
,9+,10-
,11+,12-
,13+,14-
,15-
,16+,17+,18-
,19+,20-
/m1/s1
InChIKey
GRRNUXAQVGOGFE-NZSRVPFOSA-N
SMILES
CN[C@H]
1C[C@@H]
(N)
[C@H]
(O)
[C@@H]
(O[C@@H]
2O[C@H]
(CO)
[C@H]
(O)
[C@@H]
3O[C@@]
4(O[C@H]
(C(N)
CO)
[C@H]
(O)
[C@H]
(O)
[C@H]
4O)
O[C@H]
23)
[C@@H]
1O
Roles Classification
Biological Role
(s):
antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
(via
carbohydrate-containing antibiotic
)
Application
(s):
anthelminthic drug
Substance intended to kill parasitic worms (helminths).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
hygromycin B (
CHEBI:16976
)
has role
anthelminthic drug (
CHEBI:35443
)
hygromycin B (
CHEBI:16976
)
is a
hygromycin (
CHEBI:24753
)
hygromycin B (
CHEBI:16976
)
is a
ortho ester (
CHEBI:71989
)
hygromycin B (
CHEBI:16976
)
is conjugate base of
hygromycin B(3+) (
CHEBI:57971
)
Incoming
4-
O
-phosphohygromycin B (
CHEBI:52138
)
has functional parent
hygromycin B (
CHEBI:16976
)
hygromycin B(3+) (
CHEBI:57971
)
is conjugate acid of
hygromycin B (
CHEBI:16976
)
IUPAC Name
(1
R
,2
S
,3
R
,5
S
,6
R
)-
3-
amino-
2,6-
dihydroxy-
5-
(methylamino)cyclohexyl
O
-
6-
amino-
6-
deoxy-
L
-
glycero
-
D
-
galacto
-
heptopyranosylidene-
(1→2-
3)-
β-
D
-
talopyranoside
Synonyms
Sources
Antibiotic A-396-II
KEGG COMPOUND
Hygromycin B
KEGG COMPOUND
HYGROMYCIN B
PDBeChem
O
-
6-
amino-
6-
deoxy-
L
-
glycero
-
D
-
galacto
-
heptopyranosylidene-
(1→2-
3)-
O
-
β-
D
-
talopyranosyl-
(1→5)-
2-
deoxy-
N
3
-
methyl-
D
-
streptamine
ChEBI
Manual Xrefs
Databases
C01925
KEGG COMPOUND
HYG
PDBeChem
View more database links
Registry Numbers
Types
Sources
31282-04-9
CAS Registry Number
KEGG COMPOUND
31282-04-9
CAS Registry Number
ChemIDplus
6755837
Beilstein Registry Number
Beilstein
Last Modified
04 August 2014