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(-)-Isopodophyllotoxin
SpectraBase Compound ID 2ks2xeL9P1K
InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13?,18?,19?,20-/m0/s1
InChIKey YJGVMLPVUAXIQN-OUXGVVSZSA-N
Mol Weight 414.41 g/mol
Molecular Formula C22H22O8
Exact Mass 414.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I2BEjYJuYQH
Name (-)-Isopodophyllotoxin
Alternate Name(s) (5R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one (5R)-5-oxidanyl-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
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Formula C22H22O8
InChI InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13?,18?,19?,20-/m0/s1
InChIKey YJGVMLPVUAXIQN-OUXGVVSZSA-N
Molecular Weight 414.410 g/mol
SMILES O[C@]1(c2c(cc3OCOc3c2)C(C2C1COC2=O)c1cc(OC)c(c(c1)OC)OC)[H]
SPLASH splash10-03di-0000900000-7d8e9c4ebb6511ddb3f9
Source of Spectrum QC-5-919-5
Wiley ID 883554