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> Main
CHEBI:27173 - typhasterol
Main
ChEBI Ontology
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ChEBI Name
typhasterol
ChEBI ID
CHEBI:27173
Definition
A brassinosteroid that is ergostan-6-one bearing three additional hydroxy substituents at positions 3α, 22
R
and 23
R
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C28H48O4
Net Charge
0
Average Mass
448.67830
Monoisotopic Mass
448.35526
InChI
InChI=1S/C28H48O4/c1-
15(2)
16(3)
25(31)
26(32)
17(4)
20-
7-
8-
21-
19-
14-
24(30)
23-
13-
18(29)
9-
11-
28(23,6)
22(19)
10-
12-
27(20,21)
5/h15-
23,25-
26,29,31-
32H,7-
14H2,1-
6H3/t16-
,17-
,18+,19-
,20+,21-
,22-
,23+,25+,26+,27+,28+/m0/s1
InChIKey
SBSXXCCMIWEPEE-SELDZKRUSA-N
SMILES
CC(C)
[C@H]
(C)
[C@@H]
(O)
[C@H]
(O)
[C@@H]
(C)
[C@H]
1CC[C@H]
2[C@@H]
3CC(=O)
[C@H]
4C[C@H]
(O)
CC[C@]
4(C)
[C@H]
3CC[C@]
12C
Metabolite of Species
Details
Brassica juncea
(NCBI:txid3707)
See:
PubMed
Oryza sativa
(NCBI:txid4530)
Found in seed
(BTO:0001226)
. See:
PubMed
Roles Classification
Biological Role
(s):
plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
typhasterol (
CHEBI:27173
)
has parent hydride
5α-campestane (
CHEBI:20640
)
typhasterol (
CHEBI:27173
)
has role
plant metabolite (
CHEBI:76924
)
typhasterol (
CHEBI:27173
)
is a
22-hydroxy steroid (
CHEBI:36863
)
typhasterol (
CHEBI:27173
)
is a
23-hydroxy steroid (
CHEBI:36866
)
typhasterol (
CHEBI:27173
)
is a
3α-sterol (
CHEBI:35347
)
typhasterol (
CHEBI:27173
)
is a
6-oxo steroid (
CHEBI:36883
)
typhasterol (
CHEBI:27173
)
is a
brassinosteroid (
CHEBI:22921
)
typhasterol (
CHEBI:27173
)
is a
C
28
-steroid (
CHEBI:188921
)
Incoming
6-deoxotyphasterol (
CHEBI:20717
)
has functional parent
typhasterol (
CHEBI:27173
)
IUPAC Name
(3α,5α,22
R
,23
R
,24
S
)-3,22,23-trihydroxyergostan-6-one
Synonyms
Sources
2-Deoxycastasterone
HMDB
typhasterol
UniProt
Manual Xrefs
Databases
C00000185
KNApSAcK
C15793
KEGG COMPOUND
CPD-719
MetaCyc
HMDB0034423
HMDB
View more database links
Registry Numbers
Types
Sources
3629989
Reaxys Registry Number
Reaxys
87734-68-7
CAS Registry Number
KNApSAcK
Citations
Types
Sources
11161013
PubMed citation
Europe PMC
24856112
PubMed citation
Europe PMC
25092597
PubMed citation
Europe PMC
25433632
PubMed citation
Europe PMC
25700090
PubMed citation
Europe PMC
Last Modified
17 December 2021