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neo-Isotussilagine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Neotussilagine
1 reference
based on heuristic
inferred from SMILES
mass
199.120843404
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
isotussilagine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
tussilagine
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
neo-Tussilagine
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₀H₁₇NO₃
0 references
canonical SMILES
O=C(OC)C1C2N(CCC2)CC1(O)C
0 references
isomeric SMILES
COC(=O)[C@@H]1[C@@H]2CCCN2C[C@]1(C)O
0 references
found in taxon
Ligularia sibirica
1 reference
stated in
Pyrrolizidine Alkaloids from Ligularia sibirica Cass. and Tephroseris integrifolia L.
Identifiers
InChI
InChI=1S/C10H17NO3/c1-10(13)6-11-5-3-4-7(11)8(10)9(12)14-2/h7-8,13H,3-6H2,1-2H3/t7-,8-,10-/m0/s1
0 references
InChIKey
LADVYSUMGRTFSZ-NRPADANISA-N
0 references
PubChem CID
11095620
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LADVYSUMGRTFSZ-NRPADANISA-N
UniChem compound ID
34330564
1 reference
stated in
UniChem
KNApSAcK ID
C00057078
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LADVYSUMGRTFSZ-NRPADANISA-N
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