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podophyllotoxin or 5,8.alpha.,8a-trihydro-9-deuterio-9-hydroxy-5-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one

View entire compound with spectra: 1 MS (GC)

podophyllotoxin or 5,8.alpha.,8a-trihydro-9-deuterio-9-hydroxy-5-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one
SpectraBase Compound ID 1sGQqxrzdrg
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/i18D
InChIKey YJGVMLPVUAXIQN-JQTVWJLVSA-N
Mol Weight 415.42 g/mol
Molecular Formula C22H212DO8
Exact Mass 415.137744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RjTpudzPV1
Name podophyllotoxin or 5,8.alpha.,8a-trihydro-9-deuterio-9-hydroxy-5-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21DO8
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/i18D
InChIKey YJGVMLPVUAXIQN-JQTVWJLVSA-N
Molecular Weight 415.416 g/mol
SMILES O[C@]1(c2c(cc3c(c2)OCO3)[C@]([C@@]2([C@@]1(COC2=O)[H])[H])(c1cc(OC)c(c(c1)OC)OC)[2D])[H]
SPLASH splash10-03xs-0119200000-5e3ab194b669ab27f22b
Source of Spectrum B6-0-0-0
Wiley ID 1375351