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2,6-Epoxy-2H-anthra[2,3-b]oxocin-8,13-dione, 3,4,5,6-tetrahydro-7,9,11-trihydroxy-2-methyl-
SpectraBase Compound ID 12ere7QvAN6
InChI InChI=1S/C20H16O7/c1-20-4-2-3-12(26-20)16-13(27-20)7-10-15(19(16)25)18(24)14-9(17(10)23)5-8(21)6-11(14)22/h5-7,12,21-22,25H,2-4H2,1H3/t12?,20-/m0/s1
InChIKey RYFFZJHGQCKWMV-UDRWWJRQSA-N
Mol Weight 368.34 g/mol
Molecular Formula C20H16O7
Exact Mass 368.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4MYB4K5ai3K
Name 2,6-Epoxy-2H-anthra[2,3-b]oxocin-8,13-dione, 3,4,5,6-tetrahydro-7,9,11-trihydroxy-2-methyl-
CAS Registry Number 14016-29-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16O7
InChI InChI=1S/C20H16O7/c1-20-4-2-3-12(26-20)16-13(27-20)7-10-15(19(16)25)18(24)14-9(17(10)23)5-8(21)6-11(14)22/h5-7,12,21-22,25H,2-4H2,1H3/t12?,20-/m0/s1
InChIKey RYFFZJHGQCKWMV-UDRWWJRQSA-N
Molecular Weight 368.341 g/mol
SMILES Oc1c2c(cc3c1C(c1c(cc(cc1O)O)C3=O)=O)O[C@]1(CCCC2O1)C
SPLASH splash10-02bs-2498000000-79e0acef36d26d5b49ab
Source of Spectrum W5-1989-64308-1228
Synonyms (2S)-3,4,5,6-tetrahydro-7,9,11-trihydroxy-2-methyl-2,6-epoxy-2H-anthra(2,3-b)oxocin-8,13-dione Averufin 2,6-Epoxy-2H-anthra(2,3-b)oxocin-8,13-dione, 3,4,5,6-tetrahydro-2-methyl-7,9,11-trihydroxy- 2-Methyl-7,9,11-trihydroxy-3,4,5,6-tetrahydro-2,6-epoxy-2H-anthra(2,3-b)oxocin-8,13-dione Averufine BRN 1299991
Wiley ID 1352948