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(Q82956635)
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Chromazonarol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4,4,6a,12b-Tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthen-10-ol
1 reference
based on heuristic
inferred from SMILES
mass
314.2245802
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
8-epi-Chromazonarol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
ent-Chromazonarol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(4aS,6aS,12aR,12bS)-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthen-10-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(4aR,6aS,12aR,12bS)-4,4,6a,12b-tetramethyl-1,2,3,4a,5,6,12,12a-octahydrobenzo[a]xanthen-10-ol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₀O₂
0 references
canonical SMILES
OC1=CC=C2OC3(C)CCC4C(C)(C)CCCC4(C)C3CC2=C1
0 references
isomeric SMILES
C[C@@]12CCCC([C@H]1CC[C@]3([C@H]2CC4=C(O3)C=CC(=C4)O)C)(C)C
0 references
found in taxon
Dictyopteris divaricata
1 reference
stated in
Cadinane sesquiterpenes from the brown alga Dictyopteris divaricata
Dictyopteris undulata
4 references
stated in
Cyclozonarone, a sesquiterpene-substituted benzoquinone derivative from the brown alga Dictyopteris undulata
stated in
A Piscicidal Chromanol and a Chromenol from the Brown Alga Dictyopteris undulata
stated in
Cyclozonarone, a sesquiterpene-substituted benzoquinone derivative from the brown alga Dictyopteris undulata
stated in
A Piscicidal Chromanol and a Chromenol from the Brown Alga Dictyopteris undulata
Identifiers
InChI
InChI=1S/C21H30O2/c1-19(2)9-5-10-20(3)17(19)8-11-21(4)18(20)13-14-12-15(22)6-7-16(14)23-21/h6-7,12,17-18,22H,5,8-11,13H2,1-4H3/t17-,18+,20-,21+/m1/s1
0 references
InChIKey
ZKEMVUBEPDXJPL-JYRKZWEQSA-N
0 references
CAS Registry Number
57291-88-0
0 references
PubChem CID
189164
1 reference
matched by identifier from
InChIKey
InChIKey
ZKEMVUBEPDXJPL-JYRKZWEQSA-N
UniChem compound ID
34512983
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50972809
1 reference
matched by identifier from
InChIKey
InChIKey
ZKEMVUBEPDXJPL-JYRKZWEQSA-N
DSSTOX compound identifier
DTXCID901400274
0 references
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