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(Q105343682)
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Nepetanudoside D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
7-methylidene-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carbaldehyde
1 reference
based on heuristic
inferred from SMILES
mass
342.131467664
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₂₂O₈
0 references
canonical SMILES
O=CC1=COC(OC2OC(CO)C(O)C(O)C2O)C3C(=C)CCC13
0 references
isomeric SMILES
C=C1CC[C@H]2C(C=O)=CO[C@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H]12
0 references
found in taxon
Nepeta nuda
2 references
stated in
Nepetanudosides and iridoid glucosides having novel stereochemistry from Nepeta nuda ssp. albiflora
stated in
Nepetanudosides and iridoid glucosides having novel stereochemistry from Nepeta nuda ssp. albiflora
Identifiers
InChI
InChI=1S/C16H22O8/c1-7-2-3-9-8(4-17)6-22-15(11(7)9)24-16-14(21)13(20)12(19)10(5-18)23-16/h4,6,9-16,18-21H,1-3,5H2/t9-,10+,11-,12+,13-,14+,15+,16-/m0/s1
0 references
InChIKey
XWOWAJVWMSDOBD-SAOXUDHVSA-N
0 references
PubChem CID
101992954
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
97069712
1 reference
stated in
UniChem
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