Etopophos

[4-[(5S,5aR,8aR,9R)-5-[(7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] dihydrogen phosphate

Also Known As: Etopophos|Etopofos|Etophos|ETOPOSIDE PHOSPHATE|Etoposide Phosphonate|AC1L1TOT|AC1Q6RWW|Etopophos Preservative Free|Etoposide phosphate [USAN]|Etoposide Phosphonate, Etopophos|AC-421|BMY 40481|BMY-40481-30|[4-[(5S,5aR,8aR,9R)-5-[(7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxyphenyl] dihydrogen phosphate|[4-[(5S,5aR,8aR,9R)-5-[(7,8-dihydroxy-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl)oxy]-8-oxo-5a,6,8a,9-tetrahydro-5H-isobenzofuro[5,6-f][1,3]benzodioxol-9-yl]-2,6-dimethoxy-phenyl] dihydrogen phosphate|4'-Demethylepipodophyllotoxin 9-(4,6-O-(R)-ethylidene-beta-D-glucopyranoside), 4'-(dihydrogen phosphate)|Furo(3',4':6,7)naphtho(2,3-d)-1,3-dioxol-6(5aH)-one, 5-(3,5-dimethoxy-4-(phosphonooxy)phenyl)-9-((4,6-O-ethylidene-beta-D-glucopyranosyl)oxy)-5,8,8a,9-tetrahydro-, (5R-(5alpha,5abeta,8aalpha,9beta(R*)))-|furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5ah)-one, 5-[3,5-dimethoxy-4-(phosphonooxy)phenyl]-9-[(4,6-o-ethylidenehexopyranosyl)oxy]-5,8,8a,9-tetrahydro-,(5r,5ar,8ar,9s)-

Molecular Formula	C29H33O16P
Molecular Weight	668.15063 g/mol
LogP	1.1
Topological Polar Surface Area	207.36 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	14
Rotatable Bonds	7
Exact Mass	668.15063
Heavy Atoms	46
Complexity	1532.9

Chemical Identifiers

CAS Number	117091-64-2
SMILES	CC1OCC2C(O1)C(C(C(O2)O[C@H]3[C@H]4COC(=O)[C@@H]4[C@@H](C5=CC6=C(C=C35)OCO6)C7=CC(=C(C(=C7)OC)OP(=O)(O)O)OC)O)O