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(Q105309768)
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English
(5R,8S)-4-Hydroxy-5-(hydroxymethyl)-8-[(1S)-1,5-dimethyl-4-hexenyl]-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-Hydroxy-5-(hydroxymethyl)-8-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
332.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₂₈O₄
0 references
canonical SMILES
O=C(O)C1=CC(O)=C2C(=C1)C(CCC2CO)C(C)CCC=C(C)C
0 references
isomeric SMILES
CC(C)=CCC[C@H](C)[C@@H]1CC[C@@H](CO)c2c(O)cc(C(=O)O)cc21
0 references
found in taxon
Eremophila glabra
1 reference
stated in
Serrulatane diterpenes from Eremophila spp.
Eremophila serrulata
1 reference
stated in
Antimicrobial compounds from Eremophila serrulata
Identifiers
InChI
InChI=1S/C20H28O4/c1-12(2)5-4-6-13(3)16-8-7-14(11-21)19-17(16)9-15(20(23)24)10-18(19)22/h5,9-10,13-14,16,21-22H,4,6-8,11H2,1-3H3,(H,23,24)/t13-,14-,16-/m0/s1
0 references
InChIKey
WPAIYQYGYZEDNV-DZKIICNBSA-N
0 references
PubChem CID
14466281
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WPAIYQYGYZEDNV-DZKIICNBSA-N
UniChem compound ID
97558269
1 reference
stated in
UniChem
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