N-acetyl-D-penicillamine

CAS 15537-71-0  ·  C7H13NO3S  ·  MW 191.25 g/mol

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3D model N-acetyl-D-penicillamine, CAS 15537-71-0, molecular formula C7H13NO3S, molar mass 191.25 g/mol
About N-acetyl-D-penicillamine

N-acetyl-D-penicillamine is a chemical compound registered under number CAS 15537-71-0, with the molecular formula C7H13NO3S, and a molar mass of 191.25 g/mol.

The molecule contains 25 atoms connected by 24 chemical bonds. The full systematic IUPAC name of this compound is (2S)-2-acetamido-3-methyl-3-sulfanylbutanoic acid. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 0.1 (positive value, a lipophilic compound), polar surface area PSA = 67.4 Ų, 3 donors and 4 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC7H13NO3S
Masa molowa191.25 g/mol
IUPAC(2S)-2-acetamido-3-methyl-3-sulfanylbutanoic acid
SMILESCC(=O)N[C@@H](C(=O)O)C(C)(C)S
InChIKeyMNNBCKASUFBXCO-YFKPBYRVSA-N
logP (XLogP3)0.1
PSA67.4 Ų
HBD / HBA3 / 4
PubChem CIDCID 65532 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

3 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (3 articles)

1980: 1 articles19802010: 1 articles20102019: 1 articles2019

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Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
N-Acetyl-D-penicillamine · 15537-71-0 · N-Acetylpenicillamine · N-Acetyl-3-mercapto-D-valine · D-Valine, N-acetyl-3-mercapto- · (2S)-2-acetamido-3-methyl-3-sulfanylbutanoic acid · N-Acetylpenicillamine, D- · WO11M5K6OR · N-Acetyl-2-amino-3-mercapto-3-methylbutansaeure · CHEBI:61198 · RefChem:162600 · DTXCID001526207 · 239-585-4 · (s)-2-acetamido-3-mercapto-3-methylbutanoic acid · N-Acetyl-3-mercaptovaline
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
N-acetyl-D-penicillamine — CAS 15537-71-0

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
N-acetyl-D-penicillamine (CAS 15537-71-0) — License & Provenance

Source:
N-acetyl-D-penicillamine (CAS 15537-71-0) — MolGod molecule record

Source data: PubChem CID 65532

STL: Download 3D model (503 KB)

SHA-256: 7bccfc46825e65a29bda7dbaa569b03432d265ab9294259cddfb43a48b94a6d4

Wikimedia Commons: not published yet

Source data: PubChem CID 65532

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