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(Q82519451)
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Heterocladol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-Bromo-8-chloro-1,4a-dimethyl-7-propan-2-yl-2,3,4,5,6,7,8,8a-octahydronaphthalen-1-ol
1 reference
based on heuristic
inferred from SMILES
mass
336.085555232
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₂₆BrClO
0 references
canonical SMILES
ClC1C(CCC2(C)C(Br)CCC(O)(C)C12)C(C)C
0 references
isomeric SMILES
CC(C)[C@H]1CC[C@@]2([C@H](CC[C@@]([C@H]2[C@@H]1Cl)(C)O)Br)C
0 references
found in taxon
Laurencia filiformis
2 references
stated in
Heterocladol, a halogenated selinane sesquiterpene of biosynthetic significance from the red alga Laurencia filiformis: Its isolation, crystal structure andabsolute configuration
stated in
Heterocladol, a halogenated selinane sesquiterpene of biosynthetic significance from the red alga Laurencia filiformis: Its isolation, crystal structure andabsolute configuration
Laurencia dendroidea
1 reference
stated in
Heterocladol, a halogenated selinane sesquiterpene of biosynthetic significance from the red alga Laurencia filiformis: Its isolation, crystal structure andabsolute configuration
Identifiers
InChI
InChI=1S/C15H26BrClO/c1-9(2)10-5-7-14(3)11(16)6-8-15(4,18)13(14)12(10)17/h9-13,18H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1
0 references
InChIKey
SEHJXVSWIARHOZ-ARSDKDGVSA-N
0 references
CAS Registry Number
65746-13-6
0 references
PubChem CID
21718008
1 reference
matched by identifier from
InChIKey
InChIKey
SEHJXVSWIARHOZ-ARSDKDGVSA-N
UniChem compound ID
49563143
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70617285
1 reference
matched by identifier from
InChIKey
InChIKey
SEHJXVSWIARHOZ-ARSDKDGVSA-N
DSSTOX compound identifier
DTXCID00568039
0 references
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