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(Q104967673)
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English
Petrotetrayndiol F
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
fatty alcohol
0 references
mass
672.584531672
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3R,14S)-heptatetraconta-21,27-dien-1,12,15,46-tetrayne-3,14-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₄₇H₇₆O₂
0 references
canonical SMILES
C#CCCCCCCCCCCCCCCCCCC=CCCCCC=CCCCCC#CC(O)C#CCCCCCCCCC(O)C#C
0 references
isomeric SMILES
C#CCCCCCCCCCCCCCCCCC/C=C\CCCC/C=C\CCCCC#C[C@@H](O)C#CCCCCCCCC[C@@H](O)C#C
0 references
found in taxon
Petrosia
1 reference
stated in
Cytotoxic polyacetylenic alcohols from the marine sponge Petrosia species
Identifiers
InChI
InChI=1S/C47H76O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-35-38-41-44-47(49)45-42-39-36-33-32-34-37-40-43-46(48)4-2/h1-2,22-23,28-29,46-49H,5-21,24-27,30-40,43H2/b23-22-,29-28-/t46-,47+/m0/s1
0 references
InChIKey
CPNZZXPRVXMIMZ-QVFNEXKSSA-N
0 references
PubChem CID
10462153
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
403211
1 reference
stated in
UniChem
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