C102H172N36O32S7
2639.2 g/mol
APIDanger
Ziconotide
CAS107452-89-1
Category
API
Compound Class
Peptide
Primary Use
Pharmaceutical Raw Material
Ziconotide is a synthetic peptide that replicates a naturally occurring ω-conotoxin from the venom of the cone snail Conus magus. It is a highly polar, multi-cyclic compound used as an analgesic active pharmaceutical ingredient for the management of severe chronic pain.
analgesic active pharmaceutical ingredient for intrathecal administrationresearch compound for pain mechanism studies
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 107452-89-1
Related Compounds
SimilarStructure SimilarSimilarity 0.82
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Safety Reference
Danger
H301Toxic if swallowed
H311Toxic in contact with skin
H331Toxic if inhaled
H330Fatal if inhaled
Identifiers
IUPAC Name
2-[(1R,4S,7S,13S,16R,21R,24S,27S,30S,33S,36S,39S,42R,45S,48S,54S,60S,63R,68R,71S,77S)-63-amino-13,45,54,60-tetrakis(4-aminobutyl)-4,36-bis(3-carbamimidamidopropyl)-16-carbamoyl-71-[(1R)-1-hydroxyethyl]-7,39,77-tris(hydroxymethyl)-27-[(4-hydroxyphenyl)methyl]-48-methyl-33-(2-methylpropyl)-30-(2-methylsulfanylethyl)-2,5,8,11,14,23,26,29,32,35,38,41,44,47,50,53,56,59,62,69,72,75,78,85-tetracosaoxo-18,19,65,66,81,82-hexathia-3,6,9,12,15,22,25,28,31,34,37,40,43,46,49,52,55,58,61,70,73,76,79,84-tetracosazatricyclo[40.37.4.221,68]pentaoctacontan-24-yl]acetic acid
InChIKey
BPKIMPVREBSLAJ-QTBYCLKRSA-N
SMILES
C[C@H]1C(=O)N[C@H](C(=O)N[C@H]2CSSC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@@H](CSSC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N1)CCCCN)CCCCN)N)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N3)CO)[C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)CO)CCCNC(=N)N)CC(C)C)CCSC)CC4=CC=C(C=C4)O)CC(=O)O)C(=O)N)CCCCN)CO)CCCNC(=N)N)CCCCN
Synonyms (15)
- Prialt
- Ziconotida
- Ziconotide
- o-Conotoxin MVIIA
- omega-Conotoxin M VIIA
- w-Conotoxin MVIIA
- ziconotidum