Anisodamine
CAS Registry Number®
55869-99-3
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CAS Name
AnisodamineMolecular Formula
C17H23NO4Molecular Mass
305.37Cite this Page
Anisodamine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=55869-99-3 (retrieved ) (CAS RN: 55869-99-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
62-63 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12-,13-,14+,15+,16-/m0/s1
InChIKey
InChIKey=WTQYWNWRJNXDEG-RBZJEDDUSA-N
SMILES
CN1[C@]2([C@@H](O)C[C@@]1(C[C@H](OC([C@H](CO)C3=CC=CC=C3)=O)C2)[H])[H]
Canonical SMILES
O=C(OC1CC2N(C)C(C1)C(O)C2)C(C=3C=CC=CC3)CO
Other Names for this Substance
- Benzeneacetic acid, α-(hydroxymethyl)-, (1R,3S,5R,6S)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (αS)-
- Benzeneacetic acid, α-(hydroxymethyl)-, 6-hydroxy-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [1R-[1α,3β(S*),5α,6α]]-
- Hyoscyamine, 6-hydroxy-
- 6-Hydroxyhyoscyamine
- Anisodamine
Deleted or Replaced CAS Registry Numbers
39459-41-1, 52646-91-0
