Apalcillin
CAS Registry Number®
63469-19-2
CAS Name
ApalcillinMolecular Formula
C25H23N5O6SMolecular Mass
521.54Cite this Page
Apalcillin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=63469-19-2 (retrieved ) (CAS RN: 63469-19-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C25H23N5O6S/c1-25(2)19(24(35)36)30-22(34)17(23(30)37-25)29-21(33)15(12-7-4-3-5-8-12)28-20(32)13-11-27-14-9-6-10-26-16(14)18(13)31/h3-11,15,17,19,23H,1-2H3,(H,27,31)(H,28,32)(H,29,33)(H,35,36)/t15-,17-,19+,23-/m1/s1
InChIKey
InChIKey=XMQVYNAURODYCQ-SLFBBCNNSA-N
SMILES
N(C([C@H](NC(=O)C1=C(O)C2=C(N=C1)C=CC=N2)C3=CC=CC=C3)=O)[C@H]4[C@@]5(N([C@@H](C(O)=O)C(C)(C)S5)C4=O)[H]
Canonical SMILES
O=C(O)C1N2C(=O)C(NC(=O)C(NC(=O)C=3C=NC4=CC=CN=C4C3O)C=5C=CC=CC5)C2SC1(C)C
Other Names for this Substance
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-2-[[(4-hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[[[(4-hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, [2S-[2α,5α,6β(S*)]]-
- 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 6-[[(2R)-[[(4-hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]phenylacetyl]amino]-3,3-dimethyl-7-oxo-, (2S,5R,6R)-
- 1,5-Naphthyridine, 4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid deriv.
- (2S,5R,6R)-6-[[(2R)-2-[[(4-Hydroxy-1,5-naphthyridin-3-yl)carbonyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
