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> Main
CHEBI:63468 - tirucalla-7,24-dien-3β-ol
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ChEBI Ontology
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ChEBI Name
tirucalla-7,24-dien-3β-ol
ChEBI ID
CHEBI:63468
ChEBI ASCII Name
tirucalla-7,24-dien-3beta-ol
Definition
A tirucallane triterpenoid that is tirucalla-7,24-diene substituted by a β-hydroxy group at position 3.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Kristian Axelsen
Supplier Information
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Formula
C30H50O
Net Charge
0
Average Mass
426.71740
Monoisotopic Mass
426.38617
InChI
InChI=1S/C30H50O/c1-
20(2)
10-
9-
11-
21(3)
22-
14-
18-
30(8)
24-
12-
13-
25-
27(4,5)
26(31)
16-
17-
28(25,6)
23(24)
15-
19-
29(22,30)
7/h10,12,21-
23,25-
26,31H,9,11,13-
19H2,1-
8H3/t21-
,22-
,23-
,25-
,26-
,28+,29-
,30+/m0/s1
InChIKey
DICCPNLDOZNSML-CEEMYSEHSA-N
SMILES
[H]
[C@]
1(CC[C@]
2(C)
C3=CC[C@@]
4([H]
)
C(C)
(C)
[C@@H]
(O)
CC[C@]
4(C)
[C@@]
3([H]
)
CC[C@@]
12C)
[C@@H]
(C)
CCC=C(C)
C
Metabolite of Species
Details
Dysoxylum lenticellatum
(IPNI:578201-1)
Found in leaf
(BTO:0000713)
. 95% Ethanolic extract of air-dried, powdered leaves and twigs. See:
PubMed
Dysoxylum lenticellatum
(IPNI:578201-1)
Found in twig
(BTO:0001411)
. 95% Ethanolic extract of air-dried, powdered leaves and twigs. 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
tirucalla-7,24-dien-3β-ol (
CHEBI:63468
)
has role
plant metabolite (
CHEBI:76924
)
tirucalla-7,24-dien-3β-ol (
CHEBI:63468
)
is a
tirucallane triterpenoid (
CHEBI:83211
)
IUPAC Name
(13α,14β,17α,20
S
)-lanosta-7,24-dien-3β-ol
Synonyms
Sources
(3β,13α,14β,17α,20
S
)-lanosta-7,24-dien-3-ol
IUPAC
5α-tirucalla-7,24-dien-3β-ol
ChEBI
Δ
7
-tirucallol
ChEBI
tirucalladienol
UniProt
tirucalladienol
ChEBI
Registry Number
Type
Source
2340080
Reaxys Registry Number
Reaxys
Citation
Type
Source
19445469
PubMed citation
SUBMITTER
Last Modified
01 October 2014
General Comment
2011-12-22
Needed for the new IUBMB reaction (3
S
)-2,3-epoxy-2,3-dihydrosqualene = tirucalladienol.