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(Q77505284)
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Trichoether C
bioactive natural product
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Statements
instance of
type of chemical entity
0 references
subclass of
2-({[4-(hexa-2,4-dien-1-ylidene)-2,5-dimethoxy-2-methyloxolan-3-yl]oxy}methyl)-3-propylphenol
1 reference
based on heuristic
inferred from SMILES
mass
388.224974124
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
2-[[(2S,3S,4Z,5R)-4-[(2E,4E)-hexa-2,4-dienylidene]-2,5-dimethoxy-2-methyloxolan-3-yl]oxymethyl]-3-propylphenol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₃₂O₅
0 references
canonical SMILES
OC1=CC=CC(=C1COC2C(=CC=CC=CC)C(OC)OC2(OC)C)CCC
0 references
isomeric SMILES
CC=CC=CC=C1[C@@H](OC)O[C@@](C)(OC)[C@@H]1OCc1c(O)cccc1CCC
0 references
found in taxon
Trichobotrys effusa
1 reference
stated in
Aliphatic phenolic ethers from Trichobotrys effusa
Trichobotrys effusus
1 reference
stated in
Aliphatic phenolic ethers from Trichobotrys effusa
Identifiers
InChI
InChI=1S/C23H32O5/c1-6-8-9-10-14-18-21(23(3,26-5)28-22(18)25-4)27-16-19-17(12-7-2)13-11-15-20(19)24/h6,8-11,13-15,21-22,24H,7,12,16H2,1-5H3/t21-,22+,23-/m1/s1
0 references
InChIKey
AUBCKIXAYUWPAW-XPWALMASSA-N
2 references
stated in
PubChem
PubChem CID
139586379
language of work or name
English
stated in
Natural Product Atlas
PubChem CID
139586379
language of work or name
English
PubChem CID
139586379
2 references
stated in
PubChem
PubChem CID
139586379
language of work or name
English
matched by identifier from
InChIKey
InChIKey
AUBCKIXAYUWPAW-XPWALMASSA-N
ChEBI ID
221131
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H32O5/c1-6-8-9-10-14-18-21(23(3,26-5)28-22(18)25-4)27-16-19-17(12-7-2)13-11-15-20(19)24/h6,8-11,13-15,21-22,24H,7,12,16H2,1-5H3/t21-,22+,23-/m1/s1
UniChem compound ID
170909636
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA011800
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
AUBCKIXAYUWPAW-XPWALMASSA-N
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