Triptonodiol

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Catalog Number ACM117456878
Product Name Triptonodiol
CAS Number 117456-87-8
Structure Triptonodiol
IUPAC Name (1S,4aS,10aR)-5-hydroxy-1-(hydroxymethyl)-8-methoxy-1,4a-dimethyl-7-propan-2-yl-4,9,10,10a-tetrahydro-3H-phenanthren-2-one
Molecular Weight 346.46
Molecular Formula C21H30O4
Canonical SMILES CC(C)C1=CC(=C2C(=C1OC)CCC3C2(CCC(=O)C3(C)CO)C)O
Inchi InChI=1S/C21H30O4/c1-12(2)14-10-15(23)18-13(19(14)25-5)6-7-16-20(18,3)9-8-17(24)21(16,4)11-22/h10,12,16,22-23H,6-9,11H2,1-5H3/t16-,20+,21-/m1/s1
InChIKey XGRBHDJWRPUKMD-TYCQWZJGSA-N
Purity 98%
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