Sacrotride A

Base Information

• Chemical Name: Sacrotride A
• CAS No.: 147103-04-6
• Molecular Formula: C25H50O7
• DSSTox Substance ID: DTXSID501118225
• Nikkaji Number: J1.105.375K
• Wikidata: Q27137477
• Metabolomics Workbench ID: 138945
• ChEMBL ID: CHEMBL491880
• Mol file: 147103-04-6.mol

Synonyms:Sacrotride A;CHEBI:69138;CHEMBL491880;DTXSID501118225;(1S,2R,3R,4S)-5-[(2S)-2-hydroxy-3-(10-methylhexadecoxy)propoxy]cyclopentane-1,2,3,4-tetrol;Q27137477;(1S,2R,3R,4S)-5-[(2S)-2-Hydroxy-3-[(10-methylhexadecyl)oxy]propoxy]-1,2,3,4-cyclopentanetetrol;147103-04-6;1beta-[(S)-3-[(10-Methylhexadecyl)oxy]-2-hydroxypropoxy]cyclopentane-2beta,3alpha,4beta,5alpha-tetrol

Chemical Property of Sacrotride A

Chemical Property:

• XLogP3: 4.7
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 20
• Exact Mass: 462.35565393
• Heavy Atom Count: 32
• Complexity: 423

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCC(C)CCCCCCCCCOCC(COC1C(C(C(C1O)O)O)O)O
• Isomeric SMILES: CCCCCCC(C)CCCCCCCCCOC[C@@H](COC1[C@H]([C@@H]([C@H]([C@@H]1O)O)O)O)O

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