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(Q115969989)
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English
3-[6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]propanoic acid
group of stereoisomers with the chemical formula C₁₇H₂₈O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
296.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₂₈O₄
0 references
canonical SMILES
O=C(O)CCC1C(=C)CCC2C(C)(CO)C(O)CCC12C
0 references
found in taxon
Andrographis paniculata
1 reference
stated in
ent-Labdane diterpenoid lactone stereoisomers from Andrographis paniculata
Identifiers
InChI
InChI=1S/C17H28O4/c1-11-4-6-13-16(2,12(11)5-7-15(20)21)9-8-14(19)17(13,3)10-18/h12-14,18-19H,1,4-10H2,2-3H3,(H,20,21)
0 references
InChIKey
SGEDHDKBIVWPIX-UHFFFAOYSA-N
0 references
PubChem CID
75049644
2 references
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SGEDHDKBIVWPIX-UHFFFAOYSA-N
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