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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:15618 - (3
Z
)-phycoerythrobilin
Main
ChEBI Ontology
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ChEBI Name
(3
Z
)-phycoerythrobilin
ChEBI ID
CHEBI:15618
ChEBI ASCII Name
(3Z)-phycoerythrobilin
Definition
The (3
Z
)-isomer of phycoerythrobilin.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:10896, CHEBI:224
Supplier Information
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Formulae
C33H38N4O6
C33H38N4O6
Net Charge
0
Average Mass
586.67800
Monoisotopic Mass
586.27913
InChI
InChI=1S/C33H38N4O6/c1-
7-
20-
19(6)
32(42)
37-
27(20)
14-
25-
18(5)
23(10-
12-
31(40)
41)
29(35-
25)
15-
28-
22(9-
11-
30(38)
39)
17(4)
24(34-
28)
13-
26-
16(3)
21(8-
2)
33(43)
36-
26/h7-
8,14-
15,19,26,34H,2,9-
13H2,1,3-
6H3,(H,36,43)
(H,37,42)
(H,38,39)
(H,40,41)
/b20-
7-
,27-
14-
,29-
15-
/t19-
,26-
/m1/s1
InChIKey
CNEWLWMGPFUJPG-RJSGNYMKSA-N
SMILES
C\C=C1\[C@@H]
(C)
C(=O)
N\C\1=C/C1=N/C(=C\c2[nH]
c(C[C@H]
3NC(=O)
C(C=C)
=C3C)
c(C)
c2CCC(O)
=O)
/C(CCC(O)
=O)
=C1C
ChEBI Ontology
Outgoing
(3
Z
)-phycoerythrobilin (
CHEBI:15618
)
is a
phycoerythrobilin (
CHEBI:36741
)
(3
Z
)-phycoerythrobilin (
CHEBI:15618
)
is conjugate acid of
(3
Z
)-phycoerythrobilin(2−) (
CHEBI:57438
)
Incoming
(3
Z
)-phycoerythrobilin(2−) (
CHEBI:57438
)
is conjugate base of
(3
Z
)-phycoerythrobilin (
CHEBI:15618
)
IUPAC Name
(3
Z
)-
8,12-
bis(2-
carboxyethyl)-
18-
ethenyl-
3-
ethylidene-
2,7,13,17-
tetramethyl-
2,3,15,16-
tetrahydrobiline-
1,19(21
H
,24
H
)-
dione
Synonym
Source
(3Z)-Phycoerythrobilin
KEGG COMPOUND
Manual Xref
Database
C05912
KEGG COMPOUND
View more database links
Last Modified
06 May 2015