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(Q82944181)
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English
2,3,4,9-Tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-3-carboxylic acid, (1R,3S)-
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
CID 4264556
1 reference
based on heuristic
inferred from SMILES
mass
230.105527688
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,3R)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-2-ium-3-carboxylate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl-, (1S-cis)-
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₁₃H₁₄N₂O₂
0 references
canonical SMILES
O=C(O)C1NC(C=2NC=3C=CC=CC3C2C1)C
0 references
isomeric SMILES
C[C@H]1N[C@H](C(=O)O)Cc2c1[nH]c1ccccc21
0 references
found in taxon
Lepidium meyenii
1 reference
stated in
Investigation of the tuber constituents of maca (Lepidium meyenii Walp.).
Identifiers
InChI
InChI=1S/C13H14N2O2/c1-7-12-9(6-11(14-7)13(16)17)8-4-2-3-5-10(8)15-12/h2-5,7,11,14-15H,6H2,1H3,(H,16,17)/t7-,11+/m1/s1
0 references
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
0 references
CAS Registry Number
42438-72-2
0 references
PubChem CID
6920040
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
148447
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
UniChem compound ID
11839890
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID10962488
1 reference
matched by identifier from
InChIKey
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
DSSTOX compound identifier
DTXCID901390293
0 references
UNII
0QGP5V5JAT
1 reference
matched by identifier from
InChIKey
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
QM1A4NN056
1 reference
matched by identifier from
InChIKey
InChIKey
ZUPHXNBLQCSEIA-HQJQHLMTSA-N
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