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(Q75065343)
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English
5a-Cholestan-3beta-ol
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
cholestanol
1 reference
based on heuristic
inferred from SMILES
(3R,5S,8R,9S,10S,13R,14S)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
1 reference
based on heuristic
inferred from SMILES
mass
388.370516156
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
coprostanol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
epidihydrocholesterin
1 reference
based on heuristic
inferred from InChIKey
(3S,5S,8R,9R,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Cholestan-3-ol, (3.beta.)-
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
cholestan-3-ol
1 reference
based on heuristic
inferred from InChI
Epicholestanol
1 reference
based on heuristic
inferred from InChI
(3S,5R)-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
1 reference
based on heuristic
inferred from InChI
dihydrocholesterol
1 reference
based on heuristic
inferred from InChI
(3S,5S,8S,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
1 reference
based on heuristic
inferred from InChI
epicoprosterol
1 reference
based on heuristic
inferred from InChI
Cholestan-3-ol, (3beta,5alpha)-
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₇H₄₈O
0 references
canonical SMILES
OC1CCC2(C)C(CCC3C4CCC(C(C)CCCC(C)C)C4(C)CCC32)C1
0 references
isomeric SMILES
CC(C)CCC[C@@H](C)[C@H]1CCC2C3CC[C@H]4C[C@@H](O)CC[C@]4(C)C3CC[C@@]21C
0 references
found in taxon
Cyanobacterium
1 reference
stated in
Sterols and triterpenoids from the cyanobacterium Anabaena hallensis
Identifiers
InChI
InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21+,22?,23-,24?,25?,26+,27-/m1/s1
0 references
InChIKey
QYIXCDOBOSTCEI-LFBIJMMSSA-N
2 references
stated in
PubChem
PubChem CID
18655846
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
18655846
language of work or name
English
PubChem CID
18655846
1 reference
stated in
PubChem
PubChem CID
18655846
language of work or name
English
ChEBI ID
199339
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21+,22?,23-,24?,25?,26+,27-/m1/s1
UniChem compound ID
267607
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA002084
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
QYIXCDOBOSTCEI-LFBIJMMSSA-N
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