Information from the InChI

There are no matching entries in the database for this IUPAC International Chemical Identifier. The following information was obtained from the identifier.

• Formula: C₂₁H₂₅BO₄
• Molecular weight: 352.232
• IUPAC Standard InChI:
  • InChI=1S/C21H25BO4/c1-5-6-13-22-25-20-15-11-12-17(23-3)19(24-4)18(15)14-9-7-8-10-16(14)21(20,2)26-22/h7-12,20H,5-6,13H2,1-4H3
• IUPAC Standard InChIKey: VCJDYVHZISQTRN-UHFFFAOYSA-N
• Connectivity:
• 2-d Mol File from the identifier
• Canonical atom numbers:
  Note: stereochemistry is currently not indicated in the items above.
• Stereoisomers:
  • cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, 3,4-dimethoxy, butylboronate

Contents of the identifier

Identifier version: 1S

Main section

• Formula: C21H25BO4
• Connectivity: 1-5-6-13-22-25-20-15-11-12-17(23-3)19(24-4)18(15)14-9-7-8-10-16(14)21(20,2)26-22
• Hydrogen: 7-12,20H,5-6,13H2,1-4H3