Podophyllotoxin glucoside

(5R,5aR,8aR,9R)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one

Also Known As: Podophyllotoxin glucoside|Podophyllotoxin 4-O-glucoside|prostaglandins B|podophyllotoxin-4-o-glucoside|SP-G Iia|Podophyllotoxin, glucoside|Podophyllotoxin beta-D-glucoside|Podophyllotoxin-beta-D-glucoside|Podophyllotoxin-7-O-glucoside|Podophyllotoxin 4-glucoside|KST-1A2522|KST-1A2523|Podophyllotoxin 7-O-glucopyranoside|Podophyllotoxin, 3-beta-D-glucopyranoside|HY-N1977|Podophyllotoxin, beta-D-glucopyranoside|Podophyllotoxin-beta-D-benzylidene glucoside|TN4813|podophyllotoxin beta-d-glucopyranoside|Podophyllotoxin, .beta.-D-glucopyranoside|Podophyllotoxin, 3-.|A.-D-glucopyranoside|4,6-O-Benzylide-beta-D-glucopyranosidepodophyllotoxin|Podophyllotoxin, 4,6-O-benzylidene-beta-D-glucopyranoside|(5R,5aR,8aR,9R)-5-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one|9-(beta-D-glucopyranosyloxy)-5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one (5R-(5alpha,5abeta,8aalpha,9alpha))-|PGB|(5r,5ar,8ar,9r)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl |A-d-glucopyranoside

Molecular Formula	C28H32O13
Molecular Weight	576.18427 g/mol
LogP	0.4
Topological Polar Surface Area	172.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	13
Rotatable Bonds	7
Exact Mass	576.18427
Monoisotopic Mass	576.18427
Heavy Atoms	41
Complexity	907.0

Chemical Identifiers

CAS Number	20110-25-2
SMILES	COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O
InChIKey	NXVJTGLCCSFGAT-QNDDJFOYSA-N