4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-(ethylthio)-6-[(1R)-1-hydroxyethyl]-7-oxo-, monosodium salt, (5R,6S)-
CAS Registry Number®
77646-84-5
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CAS Name
4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-(ethylthio)-6-[(1R)-1-hydroxyethyl]-7-oxo-, monosodium salt, (5R,6S)-Molecular Formula
C10H13NO4S2.NaCite this Page
4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-(ethylthio)-6-[(1R)-1-hydroxyethyl]-7-oxo-, monosodium salt, (5R,6S)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=77646-84-5 (retrieved ) (CAS RN: 77646-84-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C10H13NO4S2.Na/c1-3-16-10-6(9(14)15)11-7(13)5(4(2)12)8(11)17-10;/h4-5,8,12H,3H2,1-2H3,(H,14,15);/t4-,5+,8-;/m1./s1
InChIKey
InChIKey=WHKQYWCGMCRQOB-LAHZDFTNSA-N
SMILES
C(O)(=O)C=1N2[C@@]([C@@]([C@@H](C)O)(C2=O)[H])(SC1SCC)[H].[Na]
Canonical SMILES
[Na].O=C(O)C1=C(SCC)SC2N1C(=O)C2C(O)C
Other Names for this Substance
- 4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-(ethylthio)-6-[(1R)-1-hydroxyethyl]-7-oxo-, monosodium salt, (5R,6S)-
- 4-Thia-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid, 3-(ethylthio)-6-(1-hydroxyethyl)-7-oxo-, monosodium salt, [5R-[5α,6α(R*)]]-
