Palbinone

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Catalog Number ACM139954000
CAS 139954-00-0
Structure {[CurrentData.Name]}
IUPAC Name (3S,5R,9R,10S)-3,17-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9-hexahydro-1H-cyclopenta[a]phenanthrene-15,16-dione
Molecular Weight 358.5
Molecular Formula C22H30O4
Canonical SMILES CC1(C2CCC3(C(C2(CCC1O)C)C=CC4=C(C(=O)C(=O)C43C)O)C)C
Inchi InChI=1S/C22H30O4/c1-19(2)13-8-11-21(4)14(20(13,3)10-9-15(19)23)7-6-12-16(24)17(25)18(26)22(12,21)5/h6-7,13-15,23-24H,8-11H2,1-5H3/t13-,14+,15-,20-,21?,22?/m0/s1
InChIKey KIAKLFLISZCITK-DUYCYYQJSA-N
Purity 98%
Appearance Orange powder

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