Zizyphoiside D

[2-[2-[3,5-dihydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] acetate

Also Known As: Zizyphoiside D|2-O-Acetylrhamnopyranosyl-1-3-glucopyranosyl-1-3-arabinopyranosyl-1-3-jujubogenin|[2-[2-[3,5-dihydroxy-2-[[16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo[18.2.1.01,14.02,11.05,10.015,20]tricosan-7-yl]oxy]oxan-4-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl] acetate|20-hydroxy-16,23:16,30-diepoxydammar-24-en-3-yl 2-o-acetyl-6-deoxyhexopyranosyl-(1->3)hexopyranosyl-(1->3)pentopyranoside|20-hydroxy-16,23:16,30-diepoxydammar-24-en-3-yl 2-o-acetyl-6-deoxyhexopyranosyl-(1-|(2-(2-(3,5-dihydroxy-2-((16-hydroxy-2,6,6,10,16-pentamethyl-18-(2-methylprop-1-enyl)-19,21-dioxahexacyclo(18.2.1.01,14.02,11.05,10.015,20)tricosan-7-yl)oxy)oxan-4-yl)oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl)oxy-4,5-dihydroxy-6-methyloxan-3-yl) acetate|alpha-L-Arabinopyranoside, (3beta,16beta,23R)-16,23:16,13-diepoxy-20-hydroxydammar-24-en-3-yl O-2-O-acetyl-6-deoxy-alpha-L-mannopyranosyl-(1-3)-O-beta-D-glucopyranosyl-(1-3)-

Molecular Formula	C49H78O18
Molecular Weight	954.5188 g/mol
LogP	2.6
Topological Polar Surface Area	262.0 Ų
Hydrogen Bond Donors	8
Hydrogen Bond Acceptors	18
Rotatable Bonds	10
Exact Mass	954.5188
Monoisotopic Mass	954.5188
Heavy Atoms	67
Complexity	1860.0

Chemical Identifiers

CAS Number	19282-98-5
SMILES	CC1C(C(C(C(O1)OC2C(C(OC(C2O)OC3C(COC(C3O)OC4CCC5(C6CCC7C8C(CC(OC89CC7(C6(CCC5C4(C)C)C)CO9)C=C(C)C)(C)O)C)O)CO)O)OC(=O)C)O)O
InChIKey	VGQMQJJZSGPGOI-UHFFFAOYSA-N