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CHEBI:91221 - 2-hydroxyspheroidene
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ChEBI Ontology
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ChEBI Name
2-hydroxyspheroidene
ChEBI ID
CHEBI:91221
Definition
A carotenoid ether that is spheroidene substituted at position 2 by a hydroxy group.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
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Formula
C41H60O2
Net Charge
0
Average Mass
584.915
Monoisotopic Mass
584.45933
InChI
InChI=1S/C41H60O2/c1-
33(2)
19-
14-
22-
36(5)
25-
17-
28-
37(6)
26-
15-
23-
34(3)
20-
12-
13-
21-
35(4)
24-
16-
27-
38(7)
29-
18-
30-
39(8)
31-
32-
40(42)
41(9,10)
43-
11/h12-
13,15-
16,18-
21,23-
27,29-
32,40,42H,14,17,22,28H2,1-
11H3/b13-
12+,23-
15+,24-
16+,29-
18+,32-
31+,34-
20+,35-
21+,36-
25+,37-
26+,38-
27+,39-
30+
InChIKey
IYSJCVOSCTVRGJ-FZFXUSNISA-N
SMILES
C(=C(/CCC=C(C)C)\C)\CC/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C=C/C(C(OC)(C)C)O)\C)\C)\C)/C)/C
ChEBI Ontology
Outgoing
2-hydroxyspheroidene (
CHEBI:91221
)
has functional parent
spheroidene (
CHEBI:35330
)
2-hydroxyspheroidene (
CHEBI:91221
)
is a
carotenoid ether (
CHEBI:35329
)
2-hydroxyspheroidene (
CHEBI:91221
)
is a
carotenol (
CHEBI:23045
)
IUPAC Name
(3
E
)-1-methoxy-3,4-didehydro-1,2,7',8'-tetrahydro-ψ,ψ-caroten-2-ol
Synonyms
Sources
2-hydroxyspheroidene
UniProt
spheroiden-2-ol
MetaCyc
Manual Xref
Database
CPD-16859
MetaCyc
View more database links
Registry Number
Type
Source
1717935
Reaxys Registry Number
Reaxys
Last Modified
11 April 2016