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(Q75056811)
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English
Citreodiol
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
2,6-dimethyloctane monoterpenoid
0 references
fatty alcohol
0 references
biogenic acyclic ester
0 references
mass
214.120509056
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Epicitreodiol
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(6S,7R,2E,4E)-2,6-Dimethyl-6,7-dihydroxy-2,4-octadienoic acid methyl ester
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₁H₁₈O₄
0 references
canonical SMILES
O=C(OC)C(=CC=CC(O)(C)C(O)C)C
0 references
isomeric SMILES
C[C@H]([C@@](C)(/C=C/C=C(\C)/C(=O)OC)O)O
0 references
found in taxon
Penicillium citreonigrum
1 reference
stated in
Isolation and stereostructures of citreoviral, citreodiol, and epicitreodiol
Penicillium citrioviride
1 reference
stated in
Isolation and stereostructures of citreoviral, citreodiol, and epicitreodiol
Streptomyces rochei
1 reference
stated in
The genome sequence of Streptomyces rochei 7434AN4, which carries a linear chromosome and three characteristic linear plasmids
Identifiers
InChI
InChI=1S/C11H18O4/c1-8(10(13)15-4)6-5-7-11(3,14)9(2)12/h5-7,9,12,14H,1-4H3/b7-5+,8-6+/t9-,11-/m1/s1
0 references
InChIKey
VRPFJYGFBAJGLE-NPMAGFNESA-N
0 references
PubChem CID
6442412
2 references
stated in
PubChem
PubChem CID
6442412
language of work or name
English
matched by identifier from
InChIKey
InChIKey
VRPFJYGFBAJGLE-NPMAGFNESA-N
ChEBI ID
197854
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C11H18O4/c1-8(10(13)15-4)6-5-7-11(3,14)9(2)12/h5-7,9,12,14H,1-4H3/b7-5+,8-6+/t9-,11-/m1/s1
UniChem compound ID
65014025
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA000361
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VRPFJYGFBAJGLE-NPMAGFNESA-N
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