Description
Adenostemmoic acid E is a distinguished bioactive constituent, having gained considerable interest in the field of natural compound. Due to its remarkable anti-inflammatory attributes, this natural compound is used for studying afflictions associated with inflammation.
Synonyms
(4R,4aS,6aR,8S,9R,11S,11aR,11bR)-8,11,11a-Trihydroxy-8-(hydroxymethyl)-4,11b-dimethyl-7-oxotetradecahydro-6a,9-methanocyclohepta[a]naphthalene-4-carboxylic acid
IUPAC Name
(1R,4S,5R,9R,10R,11S,13R,14S)-10,11,14-trihydroxy-14-(hydroxymethyl)-5,9-dimethyl-15-oxotetracyclo[11.2.1.01,10.04,9]hexadecane-5-carboxylic acid
Molecular Formula
C20H30O7
Canonical SMILES
CC1(CCCC2(C1CCC34C2(C(CC(C3)C(C4=O)(CO)O)O)O)C)C(=O)O
InChI
InChI=1S/C20H30O7/c1-16(15(24)25)5-3-6-17(2)12(16)4-7-18-9-11(8-13(22)20(17,18)27)19(26,10-21)14(18)23/h11-13,21-22,26-27H,3-10H2,1-2H3,(H,24,25)/t11-,12+,13-,16+,17+,18-,19+,20+/m0/s1
InChIKey
DPPVSQWFKIAOLU-QONFGGHQSA-N
Boiling Point
604.5±55.0 °C at 760 mmHg