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English
Paxdaphnidine A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Methyl 2-methyl-5-propan-2-yl-7-azapentacyclo[10.5.1.01,6.02,9.015,18]octadec-12(18)-ene-16-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
357.26677936
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Caldaphnidine B
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₃H₃₅NO₂
0 references
canonical SMILES
O=C(OC)C1CC23C4=C(CCC41)CCC5CNC3C(CCC52C)C(C)C
0 references
isomeric SMILES
COC(=O)[C@@H]1C[C@]23C4=C(CC[C@@H]5CN[C@H]2[C@@H](C(C)C)CC[C@@]53C)CC[C@@H]41
0 references
found in taxon
Daphniphyllum paxianum
1 reference
stated in
Paxdaphnidines A and B, novel penta- and tetracyclic alkaloids from Daphniphyllum paxianum
Identifiers
InChI
InChI=1S/C23H35NO2/c1-13(2)16-9-10-22(3)15-7-5-14-6-8-17-18(21(25)26-4)11-23(22,19(14)17)20(16)24-12-15/h13,15-18,20,24H,5-12H2,1-4H3/t15-,16-,17-,18-,20+,22+,23+/m1/s1
0 references
InChIKey
ASJBAMFLUNNOSV-PQYFOXTFSA-N
0 references
PubChem CID
21573252
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ASJBAMFLUNNOSV-PQYFOXTFSA-N
UniChem compound ID
60051219
1 reference
stated in
UniChem
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