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(Q77281003)
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English
(-)-(1R,4R,5S,6R,7S, 10R)-cadinan-1,4,5-triol
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
2,5-Dimethyl-8-propan-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalene-1,2,4a-triol
1 reference
based on heuristic
inferred from SMILES
mass
256.203844756
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,2S,4aR,5R,8S,8aR)-2,5-dimethyl-8-propan-2-yl-1,3,4,5,6,7,8,8a-octahydronaphthalene-1,2,4a-triol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₈O₃
0 references
canonical SMILES
OC1C2C(CCC(C)C2(O)CCC1(O)C)C(C)C
0 references
isomeric SMILES
C[C@@H]1CC[C@H]([C@H]2[C@]1(CC[C@@]([C@H]2O)(C)O)O)C(C)C
0 references
found in taxon
Dictyopteris divaricata
2 references
stated in
Cadinane sesquiterpenes from the brown alga Dictyopteris divaricata
stated in
Cadinane sesquiterpenes from the brown alga Dictyopteris divaricata
Identifiers
InChI
InChI=1S/C15H28O3/c1-9(2)11-6-5-10(3)15(18)8-7-14(4,17)13(16)12(11)15/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1
0 references
InChIKey
NYZINEQQHFXDCC-ARSDKDGVSA-N
2 references
stated in
PubChem
PubChem CID
21589754
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
21589754
language of work or name
English
PubChem CID
21589754
2 references
stated in
PubChem
PubChem CID
21589754
language of work or name
English
matched by identifier from
InChIKey
InChIKey
NYZINEQQHFXDCC-ARSDKDGVSA-N
ChEBI ID
201031
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H28O3/c1-9(2)11-6-5-10(3)15(18)8-7-14(4,17)13(16)12(11)15/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1
UniChem compound ID
272859
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA004043
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NYZINEQQHFXDCC-ARSDKDGVSA-N
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