74123-20-9 Purity
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Specification
The molecular formula of homobrassinolide is C29H50O6.
The molecular weight of homobrassinolide is 494.7 g/mol.
Homobrassinolide was first created on February 8, 2007.
The IUPAC Name of homobrassinolide is (1S,2R,4R,5S,7S,11S,12S,15R,16S)-15-[(2S,5S)-5-ethyl-3,4-dihydroxy-6-methylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.0 2,7 .0 12,16 ]octadecan-8-one.
The Canonical SMILES of homobrassinolide is CCC(C(C)C)C(C(C(C)C1CCC2C1(CCC3C2COC(=O)C4C3(CC(C(C4)O)O)C)C)O)O.
Homobrassinolide has 4 hydrogen bond donor counts.
The XLogP3-AA value of homobrassinolide is 5.2.
The topological polar surface area of homobrassinolide is 107?2.
Homobrassinolide has 11 defined atom stereocenter counts.
Yes, homobrassinolide is a canonicalized compound.