Nodularin
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Grundinformationen
- CAS
118399-22-7- Standard-SMILES
C/C=C1/C(=O)N[C@@H](C(=O)O)[C@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](/C=C/C(C)=C/[C@H](C)[C@H](Cc2ccccc2)OC)[C@H](C)C(=O)N[C@@H](C(=O)O)CCC(=O)N1C- InChIKey
IXBQSRWSVIBXNC-HSKGSTCASA-N- Summenformel
- C41H60N8O10
- Durchschnittliche Molmasse
- 824,977 g/mol
- Monoisotopische Masse
- 824,44324012
Namen und Bezeichner
- Bevorzugter Name
- Nodularin
- IUPAC
- (2Z,5R,6S,9S,12S,13S,16R)-9-{3-[(Diaminomethylidene)amino]propyl}-2-ethylidene-12-[(1E,3E,5S,6S)-6-methoxy-3,5-dimethyl-7-phenylhepta-1,3-dien-1-yl]-1,6,13-trimethyl-3,7,10,14,19-pentaoxo-1,4,8,11,15-pentaazacyclononadecane-5,16-dicarboxylic acid
- Englischer Name
- NODULARIN
- Summenformel
- C41H60N8O10
- Molmasse
- 824.96
Namen und Synonyme
NODULARINNodularin-R solutionNodularin in methanolNodularin solutionNodularin, 5μg in 0.5 mLIXBQSRWSVIBXNC-HSKGSTCASA-NNodularin, Nodularia spumigenayl-10-phenyl-3-aminodecanoyl-d-gamma-glutamyl)1,4,8,11,15-Pentaazacyclononadecane, cyclic peptideNodularin,1,4,8,11,15-Pentaazacyclononadecane, cyclic peptide
Datenbank-Bezeichner
- CAS
118399-22-7- PubChem CID
- 14217092
- DTXSID
DTXSID60880022- ChEMBL
CHEMBL108308- ChEBI
CHEBI:80043- UNII
- 0979BIK2QU
- EC Number
- 621-437-9
Eigenschaften
Physikochemische Eigenschaften
- Dichte
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- Flammpunkt
- 11 ℃ · 11℃
- storage temp.
- 20 °C · −20°C
- Löslichkeit
- 2 mg/mL · methanol: 2 mg/mL Further dilute to 10% (v/v) methanol. Store solutions at −20°C for up to six months.
- Aggregatzustand
- Dry residue containing traces of monobasic potassium phosphate.
- pka
- 3.39 · 3.39±0.70(Predicted)
- Major Application
- cleaning productscosmeticsfood and beveragespersonal care
- InChIKey
- IXBQSRWSVIBXNC-HSKGSTCASA-N
- SMILES
- CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(C)\C=C\[C@@H]2NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)\C(=C\C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O
- EPA chemische Informationen
- Nodularin (118399-22-7)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
Sicherheitsdaten
- wgk
- 3
- ridadr
- UN 2811 6.1/PG 2
- RTECS-Nr.
- GU2294250
- risk_code
- 23/24/25-38-39/23/24/25-11-43-36/37/38-26/27/28
- Toxizität
- mouse,LD50,intraperitoneal,60ug/kg (0.06mg/kg),Chemical Research in Toxicology. Vol. 6, Pg. 151, 1993.
- hazard_code
- T,F,T+
- safety_code
- 36/37-45-16-7-36/37/39-26
- Speicherklasse
- 3 - Flammable liquids
- Giftige Stoffe Daten
- 118399-22-7(Hazardous Substances Data)
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralFlam. Liq. 2STOT SE 1
Chemie und Industrie
Anwendungen
BeschreibungThe cyanobacterium Nodularia spumigena often contaminates the drinking water of rural communities in developing countries and accumulates in mussels, flounder, and cod from the northern Baltic Sea. Nodularin is a hepatotoxic monocylic pentapeptide produced by the N. spumigena. It is a potent inhibitor of protein phosphatase types 1 (PP1) and 2A (PP2A), exhibiting IC50 values of 1.8 and 0.026 nM, respectively. PP2B is inhibited to a lesser extent with an IC50 of 1.8 μM. No apparent inhibitory effect is observed with PP2C, alkaline phosphatase, acid phosphatase, insulin receptor tyrosine kinase, protein kinase A, phosphorylase kinase, or protein kinase C.
VerwendenNodularin-R is a cyclic peptide toxin produced by freshwater cyanobacteria.
Anbieter10 Anbieter
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海宏叶生物科技有限公司400-9205774 400-920-5774 · [email protected]
四川恒诚致远生物科技有限公司18113192475 18113192475 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
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