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(Q105255975)
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English
Canditriol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(Hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-2,15-diol
1 reference
based on heuristic
inferred from SMILES
mass
320.235144884
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Kaur-16-ene-7,15,18-triol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,2S,4S,5S,9R,10S,13R,15S)-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-2,15-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
Eubotriol
1 reference
based on heuristic
inferred from InChI
(1R,2S,4S,5S,9R,10S,13R,15R)-5-(hydroxymethyl)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.01,10.04,9]hexadecane-2,15-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂O₃
0 references
canonical SMILES
OCC1(C)CCCC2(C)C3CCC4C(=C)C(O)C3(C4)C(O)CC12
0 references
isomeric SMILES
C=C1[C@H](O)[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(CO)[C@H]1C[C@H]3O
0 references
found in taxon
Mucor plumbeus
1 reference
stated in
Biotransformation of the diterpenes epicandicandiol and candicandiol by Mucor plumbeus
Sideritis infernalis
2 references
stated in
Diterpenes from sideritis infernalis
stated in
Diterpenes from sideritis infernalis
Identifiers
InChI
InChI=1S/C20H32O3/c1-12-13-5-6-14-19(3)8-4-7-18(2,11-21)15(19)9-16(22)20(14,10-13)17(12)23/h13-17,21-23H,1,4-11H2,2-3H3/t13-,14+,15-,16-,17+,18-,19+,20-/m1/s1
0 references
InChIKey
SMJRKTGCQAVGTN-SSKHUGDLSA-N
0 references
PubChem CID
20055799
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SMJRKTGCQAVGTN-SSKHUGDLSA-N
UniChem compound ID
62931879
1 reference
stated in
UniChem
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