Cymarol

5,14-dihydroxy-3-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-10-(hydroxymethyl)-13-methylspiro[1,2,3,4,6,7,8,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene-17,3'-2H-pyran]-6'-one

Also Known As: Cymarol|Strophandiol-D-cymarosid|Strophandiol-D-cymarosid [German]|EINECS 207-367-8|19-trihydroxy-,(3-beta,5-beta)-14|5-18-05-00096 (Beilstein Handbook Reference)|3-beta-(beta-D-Cymarosyloxy)-5,14,19-trihydroxy-5-beta-card-20(22)-enolide|(3beta,5beta)-3-((2,6-Dideoxy-3-O-methyl-beta-D -ribo-hexopyranosyl)oxy)-5,14,19-trihydroxycard-20(22)-enolide|Card-20(22)-enolide, 3-((2,6-dideoxy-3-O-methyl-beta-D-ribo-hexopyranosyl)oxy)-5,14,19-trihydroxy-, (3-beta,5-beta)-|3a,5a-Dihydroxy-9a-(hydroxymethyl)-11a-methyl-6'-oxo-2,3,3a,3b,4,5,5a,6,7,8,9,9a,9b,10,11,11a-hexadecahydro-2'H,6'H-spiro[cyclopenta[a]phenanthrene-1,3'-pyran]-7-yl 2,6-dideoxy-3-O-methylhexopyranoside|5,14-Dihydroxy-10-(hydroxymethyl)-13-methyl-6'-oxo-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16-hexadecahydro-2'H,6'H-spiro[cyclopenta[a]phenanthrene-17,3'-pyran]-3-yl 2,6-dideoxy-3-O-methylhexopyranoside|5,14-dihydroxy-3-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-10-(hydroxymethyl)-13-methylspiro[1,2,3,4,6,7,8,9,11,12,15,16-dodecahydrocyclopenta[a]phenanthrene-17,3'-2H-pyran]-6'-one

Molecular Formula	C30H46O9
Molecular Weight	550.3142 g/mol
LogP	2.23
Topological Polar Surface Area	134.91 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	9
Rotatable Bonds	4
Exact Mass	550.3142
Heavy Atoms	39
Complexity	1002.9

Chemical Identifiers

CAS Number	465-84-9
SMILES	CC1C(C(CC(O1)OC2CCC3(C4CCC5(C6(CCC5(C4CCC3(C2)O)O)COC(=O)C=C6)C)CO)OC)O