Alexine
CAS Registry Number®
116174-63-1
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CAS Name
AlexineMolecular Formula
C8H15NO4Molecular Mass
189.21Cite this Page
Alexine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=116174-63-1 (retrieved ) (CAS RN: 116174-63-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
160-161 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C8H15NO4/c10-3-4-7(12)8(13)6-5(11)1-2-9(4)6/h4-8,10-13H,1-3H2/t4-,5+,6+,7-,8-/m1/s1
InChIKey
InChIKey=AIQMLBKBQCVDEY-DWOUCZDBSA-N
SMILES
C(O)[C@H]1N2[C@]([C@@H](O)[C@@H]1O)([C@@H](O)CC2)[H]
Canonical SMILES
OCC1N2CCC(O)C2C(O)C1O
Other Names for this Substance
- 1H-Pyrrolizine-1,2,7-triol, hexahydro-3-(hydroxymethyl)-, (1R,2R,3R,7S,7aS)-
- 1H-Pyrrolizine-1,2,7-triol, hexahydro-3-(hydroxymethyl)-, [1R-(1α,2β,3α,7β,7aβ)]-
- (1R,2R,3R,7S,7aS)-Hexahydro-3-(hydroxymethyl)-1H-pyrrolizine-1,2,7-triol
- Alexine
- (+)-Alexine