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6,7-Demethylenedesoxypodophyllotoxin
SpectraBase Compound ID IyZgT2Igx32
InChI InChI=1S/C21H22O7/c1-25-16-6-11(7-17(26-2)20(16)27-3)18-13-8-15(23)14(22)5-10(13)4-12-9-28-21(24)19(12)18/h5-8,12,18-19,22-23H,4,9H2,1-3H3
InChIKey RINWQCSDWSZGDJ-UHFFFAOYSA-N
Mol Weight 386.4 g/mol
Molecular Formula C21H22O7
Exact Mass 386.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dok2k0r9xAx
Name 6,7-Demethylenedesoxypodophyllotoxin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O7
InChI InChI=1S/C21H22O7/c1-25-16-6-11(7-17(26-2)20(16)27-3)18-13-8-15(23)14(22)5-10(13)4-12-9-28-21(24)19(12)18/h5-8,12,18-19,22-23H,4,9H2,1-3H3
InChIKey RINWQCSDWSZGDJ-UHFFFAOYSA-N
Molecular Weight 386.400 g/mol
SMILES Oc1c(cc2CC3COC(C3C(c2c1)c1cc(OC)c(c(c1)OC)OC)=O)O
SPLASH splash10-01p9-0903000000-27403a7977c836f8f816
Source of Spectrum E1-40-1321-1
Synonyms 6,7-Dihydroxy-4-(3,4,5-trimethoxyphenyl)-3a,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3-one 6,7-Dihydroxy-4-(3,4,5-trimethoxyphenyl)-3a,4,9,9a-tetrahydro-1H-benzo[f]isobenzofuran-3-one 6,7-bis(oxidanyl)-4-(3,4,5-trimethoxyphenyl)-3a,4,9,9a-tetrahydro-1H-benzo[f][2]benzofuran-3-one
Wiley ID 1519474