CAS Registry Number®
487-58-1
CAS Name
(+)-Hypaphorine
Molecular Formula
C14H18N2O2
Compound Properties
-
Melting Point (1)
255 °C (decomp)
Source(s)
- (1) Van Romburgh, P.; Kon. Akad. v. Wetensch. Amsterdam, Wisk. en. Natk. Afd., (1911), 19, 1250-3, CAplus
Other Names and Identifiers
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
InChIKey
InChIKey=AOHCBEAZXHZMOR-ZDUSSCGKSA-N
SMILES
C([C@H]([N@+](C)(C)C)C([O-])=O)C=1C=2C(NC1)=CC=CC2
Canonical SMILES
O=C([O-])C(CC1=CNC=2C=CC=CC21)[N+](C)(C)C
Other Names for this Substance
- 1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, inner salt, (αS)-
- Hypaphorine
- Ammonium, (1-carboxy-2-indol-3-ylethyl)trimethyl-, hydroxide, inner salt
- 1H-Indole-3-ethanaminium, α-carboxy-N,N,N-trimethyl-, inner salt, (S)-
- (1-Carboxy-2-indol-3-ylethyl)trimethylammonium hydroxide, inner salt
- Tryptophan, trimethylbetaine
- Lenticin
- Lenticine
- Tryptophan betaine
- L-Hypaphorine
- Glyyunnanenine
- (+)-Hypaphorine
Deleted or Replaced CAS Registry Numbers
97045-39-1, 12673-47-1, 63767-89-5