Hyoscyamine sulfate
CAS Registry Number®
620-61-1
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CAS Name
Hyoscyamine sulfateMolecular Formula
C17H23NO3.1/2H2O4SCite this Page
Hyoscyamine sulfate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=620-61-1 (retrieved ) (CAS RN: 620-61-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C17H23NO3.H2O4S/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12;1-5(2,3)4/h2-6,13-16,19H,7-11H2,1H3;(H2,1,2,3,4)/t13-,14+,15+,16-;/m1./s1
InChIKey
InChIKey=VJFQPODMEGSXHC-PGQIENJJSA-N
SMILES
S(=O)(=O)(O)O.O(C([C@H](CO)C1=CC=CC=C1)=O)[C@@H]2C[C@]3(N(C)[C@@](C2)(CC3)[H])[H]
Canonical SMILES
O=C(OC1CC2N(C)C(CC2)C1)C(C=3C=CC=CC3)CO.O=S(=O)(O)O
Other Names for this Substance
- Benzeneacetic acid, α-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (αS)-, sulfate (2:1)
- 1αH,5αH-Tropan-3α-ol, (-)-tropate (ester), sulfate (2:1) (salt)
- Benzeneacetic acid, α-(hydroxymethyl)-, 8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, [3(S)-endo]-, sulfate (2:1) (salt)
- Benzeneacetic acid, α-(hydroxymethyl)-, (3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester, (αS)-, sulfate (2:1) (salt)
- Hyoscyamine sulfate (2:1) (salt)
Deleted or Replaced CAS Registry Numbers
1976-91-6, 3715-52-4
