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(Q77380259)
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English
(1R*,4R*,5Z,9S*)-5-isopropyl-3,3,9-trimethylbicyclo[4.3.0]nona-5-en-4-ol
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
5-Brasilen-4-ol
1 reference
based on heuristic
inferred from SMILES
mass
222.198365452
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3S)-3alpha,5,5-Trimethyl-7-isopropyl-2,3,3aalpha,4,5,6-hexahydro-1H-inden-6beta-ol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₆O
0 references
canonical SMILES
OC1C(=C2CCC(C)C2CC1(C)C)C(C)C
0 references
isomeric SMILES
C[C@@H]1CCC2=C([C@H](C(C[C@@H]12)(C)C)O)C(C)C
0 references
found in taxon
Laurencia dendroidea
1 reference
stated in
Laurencienyne B, A New Acetylenic Cyclic Ether From the Red AlgaLaurencia Obtusa
Laurencia obtusa
1 reference
stated in
Laurencienyne B, A New Acetylenic Cyclic Ether From the Red AlgaLaurencia Obtusa
Aplysia fasciata
1 reference
stated in
Metabolites from the sea hare Aplysia fasciata.
Identifiers
InChI
InChI=1S/C15H26O/c1-9(2)13-11-7-6-10(3)12(11)8-15(4,5)14(13)16/h9-10,12,14,16H,6-8H2,1-5H3/t10-,12+,14-/m1/s1
0 references
InChIKey
PFXZOGZHLWZMDT-SCDSUCTJSA-N
2 references
stated in
PubChem
PubChem CID
23427686
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
23427686
language of work or name
English
PubChem CID
23427686
2 references
stated in
PubChem
PubChem CID
23427686
language of work or name
English
matched by identifier from
InChIKey
InChIKey
PFXZOGZHLWZMDT-SCDSUCTJSA-N
ChEBI ID
203711
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H26O/c1-9(2)13-11-7-6-10(3)12(11)8-15(4,5)14(13)16/h9-10,12,14,16H,6-8H2,1-5H3/t10-,12+,14-/m1/s1
UniChem compound ID
48144570
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA006702
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PFXZOGZHLWZMDT-SCDSUCTJSA-N
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