CID 11442745

Base Information

• Chemical Name: CID 11442745
• CAS No.: 862893-75-2
• Molecular Formula: C30H44O4
• Molecular Weight: 468.7
• ChEMBL ID: CHEMBL2203595
• Metabolomics Workbench ID: 114557
• Nikkaji Number: J1.936.440B
• Wikidata: Q105256791

Synonyms:ganoderic acid TR;862893-75-2;CHEMBL2203595;(E,6R)-6-[(5R,10S,13R,14R,15S,17R)-15-hydroxy-4,4,10,13,14-pentamethyl-3-oxo-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methylhept-2-enoic acid;BDBM50104753;AKOS040733228;MS-28656;HY-129150;CS-0103779

Chemical Property of CID 11442745

Chemical Property:

• XLogP3: 5.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 468.32395988
• Heavy Atom Count: 34
• Complexity: 984

Purity/Quality:

≥98% ^*data from raw suppliers

GanodericacidTR ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(CCC=C(C)C(=O)O)C1CC(C2(C1(CC=C3C2=CCC4C3(CCC(=O)C4(C)C)C)C)C)O
• Isomeric SMILES: C[C@H](CC/C=C(\C)/C(=O)O)[C@H]1C[C@@H]([C@@]2([C@@]1(CC=C3C2=CC[C@@H]4[C@@]3(CCC(=O)C4(C)C)C)C)C)O

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