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(Q104957913)
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English
(3S,8S)-heptadec-9-en-4,6-diyne-3,8-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
heptadec-9-en-4,6-diyne-3,8-diol
1 reference
based on heuristic
inferred from SMILES
mass
262.193280072
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
oplopandiol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3S,8S,9E)-heptadec-9-en-4,6-diyne-3,8-diol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3R,8S,9Z)-heptadec-9-en-4,6-diyne-3,8-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₇H₂₆O₂
0 references
canonical SMILES
OC(C#CC#CC(O)CC)C=CCCCCCCC
0 references
isomeric SMILES
CCCCCCCC=C[C@H](O)C#CC#C[C@@H](O)CC
0 references
found in taxon
Angelica sinensis
2 references
stated in
Molecular genetic and chemical assessment of radix Angelica (Danggui) in China
stated in
Anti-TB polyynes from the roots of Angelica sinensis
Oplopanax horridus
2 references
stated in
Antimycobacterial polyynes of Devil's Club (Oplopanax horridus), a North American native medicinal plant
stated in
Sesquiterpenes from Oplopanax horridus
Identifiers
InChI
InChI=1S/C17H26O2/c1-3-5-6-7-8-9-10-14-17(19)15-12-11-13-16(18)4-2/h10,14,16-19H,3-9H2,1-2H3/t16-,17-/m0/s1
0 references
InChIKey
CGMZKZLQZWZKJO-IRXDYDNUSA-N
0 references
PubChem CID
467779
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CGMZKZLQZWZKJO-IRXDYDNUSA-N
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