D,L-Alanosine Sodium Salt - ≥98% , CAS No.5854-95-5 free acid

CAS: 5854-95-5 free acid Cat. No.: D343339 Molecular Weight: 171.09 PubChem CID: 135413540

GRADE & PURITY ≥98%

Synonyms

5854-95-5 free acid | (S)-2-amino-3-(hydroxy(nitroso)amino)propanoic acid | NCI60_001083 | Propionic acid, (L)- | Propionic acid, L- | DL-2-Amino-3-(hydroxynitrosamino)propionic acid | Propionic acid, DL- | D,L-Alanosine Sodium Salt | ALANOSINE, DL | L-Al

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Overview

D,L-Alanosine is an antibiotic substance isolated from the fermentation of Streptomyces alanosinicus. D,L-Alanosine is also an experimental insect reproduction inhibitor.

Specifications

Synonyms

5854-95-5 free acid | (S)-2-amino-3-(hydroxy(nitroso)amino)propanoic acid | NCI60_001083 | Propionic acid, (L)- | Propionic acid, L- | DL-2-Amino-3-(hydroxynitrosamino)propionic acid | Propionic acid, DL- | D, L-Alanosine Sodium Salt | ALANOSINE, DL | L-Al

Specifications & Purity

≥98%

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Product Properties

• pKa: pKₐ: 2.01 (Predicted), pKₐ: 8.99 (Predicted)

Names and Identifiers

• Canonical Smiles: C(C(C(=O)O)N)[N+](=NO)[O-]
• IUPAC Name: (Z)-(2-amino-2-carboxyethyl)-hydroxyimino-oxidoazanium
• InChIKey: ZGNLFUXWZJGETL-WAYWQWQTSA-N
• INCHI: 1S/C3H7N3O4/c4-2(3(7)8)1-6(10)5-9/h2,9H,1,4H2,(H,7,8)/b6-5-
• Isomeric SMILES: C(C(C(=O)O)N)/[N+](=N/O)/[O-]
• RTECS: UE6490000
• PubChem CID: 135413540
• Molecular Weight: 171.09

Associated Targets(Human)

A498 (42825 Activities)

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ACHN (49357 Activities)

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CAKI-1 (44928 Activities)

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CCRF-CEM (65223 Activities)

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COLO 205 (50209 Activities)

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DU-145 (51482 Activities)

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HL-60 (67320 Activities)

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HT-29 (80576 Activities)

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K562 (73714 Activities)

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KM12 (47707 Activities)

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M14 (47487 Activities)

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MCF7 (126967 Activities)

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MOLT-4 (49676 Activities)

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OVCAR-3 (48710 Activities)

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OVCAR-4 (44535 Activities)

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OVCAR-5 (45555 Activities)

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OVCAR-8 (47708 Activities)

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PC-3 (62116 Activities)

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RPMI-8226 (44974 Activities)

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RXF 393 (41971 Activities)

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SF-295 (48000 Activities)

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SK-MEL-2 (46422 Activities)

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SK-MEL-28 (48833 Activities)

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SK-MEL-5 (47095 Activities)

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SK-OV-3 (52876 Activities)

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SN12C (47755 Activities)

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SNB-19 (46794 Activities)

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TK-10 (45540 Activities)

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U-251 (51189 Activities)

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UACC-257 (46019 Activities)

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UACC-62 (47335 Activities)

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UO-31 (46270 Activities)

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786-0 (47912 Activities)

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A549 (127892 Activities)

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NCI/ADR-RES (33767 Activities)

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T47D (39041 Activities)

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EKVX (44102 Activities)

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NCI-H322M (45589 Activities)

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HCC 2998 (41480 Activities)

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HCT-116 (91556 Activities)

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HOP-92 (41141 Activities)

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Hs-578T (29457 Activities)

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NCI-H460 (60772 Activities)

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SF-268 (49410 Activities)

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IGROV-1 (47897 Activities)

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LOX IMVI (44321 Activities)

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HOP-62 (47048 Activities)

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MDA-MB-435 (38290 Activities)

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MDA-N (28205 Activities)

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Malme-3M (44254 Activities)

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Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in 1N HCl, 1N NaOH, and alkaline water.
• Refractive Index: n20D1.62 (Predicted)
• Boil Point(°C): ~366.9° C at 760 mmHg (Predicted)
• Melt Point(°C): >180° C (dec.)
• Molecular Weight: 149.110 g/mol
• XLogP3: -3.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 149.044 Da
• Monoisotopic Mass: 149.044 Da
• Topological Polar Surface Area: 125.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 156.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

References

1. Zhi-feng Cai, Hao-yang Li, Xian-song Wang, Can Min, Jia-qi Wen, Rui-xin Fu, Zi-yue Dai, Jing Chen, Ming-zhu Guo, Hui-juan Yang, Ping-ping Bai, Xiao-mi Lu, Tao Wu, Ying Wu.  (2022)  Highly luminescent copper nanoclusters as temperature sensors and “turn off” detection of oxytetracycline.  COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS,      [PMID:] [10.1016/j.colsurfa.2022.129202]