Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: CID 51062757
CAS No.: 9013-20-1
Molecular formula: C14H17BRClNO2S
Molecular weight: 378.7 g/mol
SMILES: C1CC[N+](=C(C2=CC(=CC=C2)Cl)SCC(=O)O)CC1.[Br-]
Structural class:
Other identifiers:

Strepavidin

Streptavidin

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 1mg 生物技术级,17u/mg 304 -20℃ in stock -
Kehua Intelligence 5mg 生物技术级,17u/mg 1160 -20℃ in stock -
Kehua Intelligence 10mg 生物技术级,17u/mg 2080 -20℃ in stock -
Kehua Intelligence 50mg 生物技术级,17u/mg 6000 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-[(3-chlorophenyl)-piperidin-1-ium-1-ylidenemethyl]sulfanylacetic acid;bromide


4.2 InChI

InChI=1S/C14H16ClNO2S.BrH/c15-12-6-4-5-11(9-12)14(19-10-13(17)18)16-7-2-1-3-8-16;/h4-6,9H,1-3,7-8,10H2;1H


4.3 InChIKey

RTWACOLFHOBGCE-UHFFFAOYSA-N


4.4 Canonical SMILES

C1CC[N+](=C(C2=CC(=CC=C2)Cl)SCC(=O)O)CC1.[Br-]


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon
-- No 3D model data available --