99026-79-6 Purity
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The molecular formula of Ophiobolin A is C25H36O4.
The molecular weight of Ophiobolin A is 400.5 g/mol.
Some synonyms for Ophiobolin A include Cochliobolin A and Ophiobolin.
The IUPAC Name of Ophiobolin A is (1'R,2S,3S,3'S,4'R,5R,7'S,8'E,11'R)-4'-hydroxy-1',3,4'-trimethyl-5-(2-methylprop-1-enyl)-6'-oxospiro[oxolane-2,12'-tricyclo[9.3.0.0 3,7 ]tetradec-8-ene]-8'-carbaldehyde.
The Canonical SMILES of Ophiobolin A is CC1CC(OC12CCC3(C2CC=C(C4C(C3)C(CC4=O)(C)O)C=O)C)C=C(C)C.
Other identifiers for Ophiobolin A include CAS number 4611-05-6, ChEMBL ID CHEMBL522808, and KEGG ID C09145.
The XLogP3-AA value of Ophiobolin A is 3.5.
Ophiobolin A has 1 hydrogen bond donor count.
The topological polar surface area of Ophiobolin A is 63.6 Ų.
Ophiobolin A can be found in Bipolaris oryzae, Bipolaris maydis, and other organisms with available data.