sodium;[(4S)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl] sulfate
Grundinformationen
- CAS
1271318-61-6- Standard-SMILES
C[C@@H](CCCOS(=O)(=O)[O-])[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C.[Na+]- InChIKey
DHGPBNKCHYMHIS-OPBQQCMKSA-M- Summenformel
- C24H41NaO7S
- Durchschnittliche Molmasse
- 496,6 g/mol
- Monoisotopische Masse
- 496,2470691
Namen und Bezeichner
- Bevorzugter Name
- sodium;[(4S)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl] sulfate
- IUPAC
- sodium [(4S)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl] sulfate
- Englischer Name
- Petromyzonol-24-sulfate, sodium salt
- Summenformel
- C24H42O7S.Na
- Molmasse
- 497.64
Namen und Synonyme
1271318-61-6Petromyzonol 24-Sulfate Sodium Saltsodium;[(4S)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentyl] sulfatePetromyzonol-24-Sulfate, Sodium SaltDTXSID70858292Sodium (20S)-3alpha,7alpha,12alpha-trihydroxy-5alpha-cholan-24-yl sulfateDHGPBNKCHYMHIS-OPBQQCMKSA-MPetroMyzonol Sulfate SodiuMPetromyzonol24-SulfateSodiumSal5α-PetroMyzonol-24-sulfate SodiuM5α-Cholane-3α,7α,12α,24-tetrol 24-(Hydrogen Sulfate) SodiuM(3α,5α,7α,12α)-Cholane-3,7,12,24-tetrol 24-(Hydrogen Sulfate) SodiuM
Datenbank-Bezeichner
- CAS
1271318-61-6- PubChem CID
- 71751548
- DTXSID
DTXSID70858292
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 136 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 33
- Formalladung
- 0
- Komplexität
- 788
Physikochemische Eigenschaften
- Schmelzpunkt
- 152 °C · >152°C (dec.)
- storage temp.
- -20 °C · Hygroscopic, -20°C Freezer, Under inert atmosphere
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly), Water (Slightly)
- Aggregatzustand
- Solid
- Farbe
- Off-White
- Stabilität
- Hygroscopic
Chemie und Industrie
Anwendungen
VerwendenPetromyzonol sulfate (PZS) is a bile salt derivative isolated from the sea lamprey (Petromyzon marinus ) ammocoete (larval form). PZS appears to be a spawning chemoattractant for the sea lamprey.
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