Products 113866-64-1

CAS 113866-64-1 is the registry number for Pedunculagin. Offered by: TRC. Available pack sizes: 10mg.

Pedunculagin
TRC
  • size: 10mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

7,8,9,12,13,14,20,28,29,30,33,34,35-tridecahydroxy-3,18,21,24,39-pentaoxaheptacyclo[20.17.0.02,19.05,10.011,16.026,31.032,37]nonatriaconta-5,7,9,11,13,15,26,28,30,32,34,36-dodecaene-4,17,25,38-tetrone (CAS 113866-64-1) is a chemical compound with the molecular formula C34H24O22 and a molecular weight of 784.5 g/mol. IUPAC name: 7,8,9,12,13,14,20,28,29,30,33,34,35-tridecahydroxy-3,18,21,24,39-pentaoxaheptacyclo[20.17.0.02,19.05,10.011,16.026,31.032,37]nonatriaconta-5,7,9,11,13,15,26,28,30,32,34,36-dodecaene-4,17,25,38-tetrone. InChIKey: IYMHVUYNBVWXKH-UHFFFAOYSA-N.

Identity
Molecular formulaC34H24O22
Molecular weight784.5 g/mol
IUPAC name7,8,9,12,13,14,20,28,29,30,33,34,35-tridecahydroxy-3,18,21,24,39-pentaoxaheptacyclo[20.17.0.02,19.05,10.011,16.026,31.032,37]nonatriaconta-5,7,9,11,13,15,26,28,30,32,34,36-dodecaene-4,17,25,38-tetrone
InChIKeyIYMHVUYNBVWXKH-UHFFFAOYSA-N
SMILESC1C2C(C3C(C(O2)O)OC(=O)C4=CC(=C(C(=C4C5=C(C(=C(C=C5C(=O)O3)O)O)O)O)O)O)OC(=O)C6=CC(=C(C(=C6C7=C(C(=C(C=C7C(=O)O1)O)O)O)O)O)O

Computed by PubChem (NCBI)

Synonyms: Pedunculagin I, orb1981772