Adenostemmoic Acid B

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Catalog Number ACM130217162
CAS 130217-16-2
IUPAC Name (1R,4S,5R,9R,10R,11S,13S)-10,11-dihydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Molecular Weight 348.4
Molecular Formula C20H28O5
Canonical SMILES CC1(CCCC2(C1CCC34C2(C(CC(C3)C(=C)C4=O)O)O)C)C(=O)O
Inchi InChI=1S/C20H28O5/c1-11-12-9-14(21)20(25)18(3)7-4-6-17(2,16(23)24)13(18)5-8-19(20,10-12)15(11)22/h12-14,21,25H,1,4-10H2,2-3H3,(H,23,24)/t12-,13-,14+,17-,18-,19+,20-/m1/s1
InChIKey UVEPVLCUQGRNSH-WPUCUGSTSA-N
Purity 98%
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