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Catalog Number | ACM487581 |
CAS Number | 487-58-1 |
Synonyms | Lenticin |
IUPAC Name | (2S)-3-(1H-Indol-3-yl)-2-(trimethylazaniumyl)propanoate |
Molecular Weight | 246.30 |
Molecular Formula | C14H18N2O2 |
Canonical SMILES | C[N+](C)(C)C(CC1=CNC2=CC=CC=C21)C(=O)[O-] |
InChI | InChI=1S/C14H18N2O2/c1-16(2,3)13(14(17)18)8-10-9-15-12-7-5-4-6-11(10)12/h4-7,9,13,15H,8H2,1-3H3/t13-/m0/s1 |
InChI Key | AOHCBEAZXHZMOR-ZDUSSCGKSA-N |
Purity | 98%+ (HPLC) |
Storage | Store in dry, low temperature, sealed, 2-8 °C. |
Complexity | 306 |
Exact Mass | 246.136827821 |
Heavy Atom Count | 18 |
Isomeric SMILES | C[N+](C)(C)[C@@H](CC1=CNC2=CC=CC=C21)C(=O)[O-] |
Monoisotopic Mass | 246.136827821 |
Topological Polar Surface Area | 55.9Ų |
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