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> Main
CHEBI:71314 - cycloastragenol
Main
ChEBI Ontology
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ChEBI Name
cycloastragenol
ChEBI ID
CHEBI:71314
Definition
A sapogenin that is the aglycone derivative of astragaloside IV, a major saponin extracted from the root of
Astragalus membranaceus
.
Stars
This entity has been manually annotated by the ChEBI Team.
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Read full article at Wikipedia
Formula
C30H50O5
Net Charge
0
Average Mass
490.71500
Monoisotopic Mass
490.36582
InChI
InChI=1S/C30H50O5/c1-
24(2)
20(33)
8-
11-
30-
16-
29(30)
13-
12-
26(5)
23(28(7)
10-
9-
21(35-
28)
25(3,4)
34)
18(32)
15-
27(26,6)
19(29)
14-
17(31)
22(24)
30/h17-
23,31-
34H,8-
16H2,1-
7H3/t17-
,18-
,19-
,20-
,21-
,22-
,23-
,26+,27-
,28+,29-
,30+/m0/s1
InChIKey
WENNXORDXYGDTP-UOUCMYEWSA-N
SMILES
[H]
[C@@]
12C[C@H]
(O)
[C@@]
3([H]
)
C(C)
(C)
[C@@H]
(O)
CC[C@@]
33C[C@@]
13CC[C@]
1(C)
[C@]
([H]
)
([C@@H]
(O)
C[C@@]
21C)
[C@@]
1(C)
CC[C@H]
(O1)
C(C)
(C)
O
Roles Classification
Biological Role
(s):
metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cycloastragenol (
CHEBI:71314
)
has parent hydride
5α-gonane (
CHEBI:35525
)
cycloastragenol (
CHEBI:71314
)
has role
metabolite (
CHEBI:25212
)
cycloastragenol (
CHEBI:71314
)
is a
oxolanes (
CHEBI:26912
)
cycloastragenol (
CHEBI:71314
)
is a
pentacyclic triterpenoid (
CHEBI:25872
)
cycloastragenol (
CHEBI:71314
)
is a
sapogenin (
CHEBI:26606
)
cycloastragenol (
CHEBI:71314
)
is a
tetrol (
CHEBI:33573
)
Incoming
astragaloside I (
CHEBI:91024
)
has functional parent
cycloastragenol (
CHEBI:71314
)
astragaloside II (
CHEBI:91026
)
has functional parent
cycloastragenol (
CHEBI:71314
)
astragaloside III (
CHEBI:2897
)
has functional parent
cycloastragenol (
CHEBI:71314
)
astragaloside IV (
CHEBI:65457
)
has functional parent
cycloastragenol (
CHEBI:71314
)
IUPAC Name
(3β,6α,9β,16β,20
R
,24
S
)-
20,24-
epoxy-
9,19-
cyclolanostane-
3,6,16,25-
tetrol
Manual Xref
Database
Cycloastragenol
Wikipedia
View more database links
Registry Numbers
Types
Sources
4238706
Reaxys Registry Number
Reaxys
84605-18-5
CAS Registry Number
ChemIDplus
Citations
Types
Sources
20809612
PubMed citation
Europe PMC
20877137
PubMed citation
Europe PMC
22083896
PubMed citation
Europe PMC
23261488
PubMed citation
Europe PMC
23357596
PubMed citation
Europe PMC
Last Modified
28 January 2016