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(Q105194260)
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English
(1S,16R,17R)-4,17-dimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraene-5,16-diol
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4,17-Dimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraene-5,16-diol
1 reference
based on heuristic
inferred from SMILES
mass
331.17835828
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,16S,17R)-4,17-dimethoxy-11-azatetracyclo[9.7.0.01,14.02,7]octadeca-2,4,6,14-tetraene-5,16-diol
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₉H₂₅NO₄
0 references
canonical SMILES
OC=1C=C2C(=CC1OC)C34C(=CC(O)C(OC)C3)CCN4CCC2
0 references
isomeric SMILES
COc1cc2c(cc1O)CCCN1CCC3=C[C@@H](O)[C@H](OC)C[C@]321
0 references
found in taxon
Athrotaxis cupressoides
1 reference
stated in
Athrotaxis alkaloids. Part I. Alkaloids of A. Cupressoides
Athrotaxis laxifolia
1 reference
stated in
Athrotaxis alkaloids. Part II. Alkaloids of a. selaginoides and a. laxifolia
Athrotaxis selaginoides
1 reference
stated in
Athrotaxis alkaloids. Part II. Alkaloids of a. selaginoides and a. laxifolia
Identifiers
InChI
InChI=1S/C19H25NO4/c1-23-17-10-14-12(8-15(17)21)4-3-6-20-7-5-13-9-16(22)18(24-2)11-19(13,14)20/h8-10,16,18,21-22H,3-7,11H2,1-2H3/t16-,18-,19+/m1/s1
0 references
InChIKey
OMBJJWJYNOUKBK-QRQLOZEOSA-N
0 references
PubChem CID
162902504
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OMBJJWJYNOUKBK-QRQLOZEOSA-N
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