Ancistrobrevine B

Base Information

• Chemical Name: Ancistrobrevine B
• CAS No.: 146471-74-1
• Molecular Formula: C25H29 N O4
• Nikkaji Number: J503.467A
• Wikidata: Q105342879
• Mol file: 146471-74-1.mol

Synonyms:Ancistrobrevine B;(-)-Ancistrobrevine B;146471-74-1;6-Isoquinolinol, 5-(4,5-dimethoxy-7-methyl-1-naphthalenyl)-1,2,3,4-tetrahydro-8-methoxy-1,3-dimethyl-, (1S,3S,5R)-

Chemical Property of Ancistrobrevine B

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 407.20965841
• Heavy Atom Count: 30
• Complexity: 573

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MSDS Files:

Useful:

• Canonical SMILES: CC1CC2=C(C(=CC(=C2C(N1)C)OC)O)C3=C4C=C(C=C(C4=C(C=C3)OC)OC)C
• Isomeric SMILES: C[C@H]1CC2=C(C(=CC(=C2[C@@H](N1)C)OC)O)C3=C4C=C(C=C(C4=C(C=C3)OC)OC)C

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