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> Main
CHEBI:62455 - germanicol
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ChEBI Ontology
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ChEBI Name
germanicol
ChEBI ID
CHEBI:62455
Definition
A pentacyclic triterpenoid that is oleanane substituted by a hydroxy group at the 3β-position and with a double bond between positioins 18 and 19.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C30H50O
Net Charge
0
Average Mass
426.71740
Monoisotopic Mass
426.38617
InChI
InChI=1S/C30H50O/c1-
25(2)
15-
16-
27(5)
17-
18-
29(7)
20(21(27)
19-
25)
9-
10-
23-
28(6)
13-
12-
24(31)
26(3,4)
22(28)
11-
14-
30(23,29)
8/h19-
20,22-
24,31H,9-
18H2,1-
8H3/t20-
,22+,23-
,24+,27-
,28+,29-
,30-
/m1/s1
InChIKey
QMUXVPRGNJLGRT-PNTWTTAKSA-N
SMILES
[H]
[C@]
12CC[C@]
3([H]
)
[C@@]
4(C)
CC[C@H]
(O)
C(C)
(C)
[C@]
4([H]
)
CC[C@@]
3(C)
[C@]
1(C)
CC[C@@]
1(C)
CCC(C)
(C)
C=C21
ChEBI Ontology
Outgoing
germanicol (
CHEBI:62455
)
has parent hydride
oleanane (
CHEBI:36481
)
germanicol (
CHEBI:62455
)
is a
pentacyclic triterpenoid (
CHEBI:25872
)
germanicol (
CHEBI:62455
)
is a
secondary alcohol (
CHEBI:35681
)
IUPAC Name
(3β)-olean-18-en-3-ol
Synonyms
Sources
5α-olean-18-en-3β-ol
ChEBI
germanicol
UniProt
olean-18-en-3β-ol
ChEBI
Manual Xref
Database
GERMANICOL
MetaCyc
View more database links
Registry Numbers
Types
Sources
2063474
Reaxys Registry Number
Reaxys
465-02-1
CAS Registry Number
ChemIDplus
Citations
Types
Sources
17803686
PubMed citation
Europe PMC
18597440
PubMed citation
Europe PMC
Last Modified
22 October 2012