The molecular formula of the compound is C18H24O3.
What is the molecular weight of the compound?
The molecular weight of the compound is 288.4 g/mol.
What is the IUPAC name of the compound?
The IUPAC name of the compound is (8R,9S,13S,14S,16S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,16,17-triol.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16+,17-,18+/m1/s1.
What is the InChIKey of the compound?
The InChIKey of the compound is PROQIPRRNZUXQM-LMMHAMTPSA-N.
What is the Canonical SMILES of the compound?
The Canonical SMILES of the compound is CC12CCC3C(C1CC(C2O)O)CCC4=C3C=CC(=C4)O.
What is the CAS number of the compound?
The CAS number of the compound is 793-89-5.
What is the XLogP3 value of the compound?
The XLogP3 value of the compound is 2.5.
How many hydrogen bond donor counts does the compound have?
The compound has 3 hydrogen bond donor counts.
How many hydrogen bond acceptor counts does the compound have?
The compound has 3 hydrogen bond acceptor counts.
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