14-Deoxycaesalpin

Catalog	BBC279683464
CAS	279683-46-4
Synonyms	14-Deoxy-epsilon-caesalpin
IUPAC Name	[(1R,2S,4aR,6aS,7R,11aS,11bS)-1-acetyloxy-4a-hydroxy-4,4,7,11b-tetramethyl-2,3,5,6,6a,7,11,11a-octahydro-1H-naphtho[2,1-f][1]benzofuran-2-yl] acetate
Molecular Weight	418.52
Molecular Formula	C24H34O6
Canonical SMILES	C[C@@H]1[C@@H]2CC[C@@]3([C@@]([C@H]2CC4=C1C=CO4)([C@H]([C@H](CC3(C)C)OC(=O)C)OC(=O)C)C)O
InChI	InChI=1S/C24H34O6/c1-13-16-7-9-24(27)22(4,5)12-20(29-14(2)25)21(30-15(3)26)23(24,6)18(16)11-19-17(13)8-10-28-19/h8,10,13,16,18,20-21,27H,7,9,11-12H2,1-6H3/t13-,16+,18+,20+,21+,23+,24-/m1/s1
InChI Key	JMOFRLILFOJJEZ-ZWZFWQKWSA-N
Boiling Point	487.0±45.0 °C
Purity	98%
Density	1.19±0.1 g/ml
Appearance	Solid