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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:43467 - immucillin G
Main
ChEBI Ontology
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ChEBI Name
immucillin G
ChEBI ID
CHEBI:43467
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Molfile
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Formula
C11H15N5O4
Net Charge
0
Average Mass
281.26810
Monoisotopic Mass
281.11240
InChI
InChI=1S/C11H15N5O4/c12-
11-
15-
5-
3(1-
13-
7(5)
10(20)
16-
11)
6-
9(19)
8(18)
4(2-
17)
14-
6/h1,4,6,8-
9,13-
14,17-
19H,2H2,(H3,12,15,16,20)
/t4-
,6+,8-
,9+/m1/s1
InChIKey
KBIDJCVAURJXFG-PVEDRDFWSA-N
SMILES
Nc1nc2c(c[nH]c2c(=O)[nH]1)[C@@H]1N[C@H](CO)[C@@H](O)[C@H]1O
ChEBI Ontology
Outgoing
immucillin G (
CHEBI:43467
)
is a
dihydroxypyrrolidine (
CHEBI:46776
)
immucillin G (
CHEBI:43467
)
is a
pyrrolopyrimidine (
CHEBI:38670
)
IUPAC Name
2-
amino-
7-
[(2
S
,3
S
,4
R
,5
R
)-
3,4-
dihydroxy-
5-
(hydroxymethyl)pyrrolidin-
2-
yl]-
1,5-
dihydro-
4
H
-
pyrrolo[3,2-
d
]pyrimidin-
4-
one
Synonyms
Sources
(1
S
)-1,4-dideoxy-1,4-imino-1-(9-deazaguanin-9-yl)-
D
-ribitol
IUPAC
1,4-DIDEOXY-1,4-IMINO-1-(S)-(9-DEAZAGUANIN-9-YL)-D-RIBITOL
PDBeChem
Manual Xref
Database
IMG
PDBeChem
View more database links
Registry Number
Type
Source
8581250
Beilstein Registry Number
Beilstein
Last Modified
02 December 2009