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Picras-2-ene-1,16-dione, 11,13,14-trihydroxy-2,12-dimethoxy-, (11.alpha.,12.beta.)-
SpectraBase Compound ID 1SR3b7K5Wlu
InChI InChI=1S/C22H32O8/c1-10-7-12(28-5)17(25)19(2)11(10)8-13-20(3)16(19)15(24)18(29-6)21(4,26)22(20,27)9-14(23)30-13/h7,10-11,13,15-16,18,24,26-27H,8-9H2,1-6H3
InChIKey WTMHOKZZJFYIGE-UHFFFAOYSA-N
Mol Weight 424.5 g/mol
Molecular Formula C22H32O8
Exact Mass 424.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kn4wa7wJgwm
Name Picras-2-ene-1,16-dione, 11,13,14-trihydroxy-2,12-dimethoxy-, (11.alpha.,12.beta.)-
CAS Registry Number 30248-06-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O8
InChI InChI=1S/C22H32O8/c1-10-7-12(28-5)17(25)19(2)11(10)8-13-20(3)16(19)15(24)18(29-6)21(4,26)22(20,27)9-14(23)30-13/h7,10-11,13,15-16,18,24,26-27H,8-9H2,1-6H3
InChIKey WTMHOKZZJFYIGE-UHFFFAOYSA-N
Molecular Weight 424.490 g/mol
SMILES OC12C(C(C(C3C4(C(C(=CC(C4CC(OC(C2)=O)C13C)C)OC)=O)C)O)OC)(C)O
SPLASH splash10-0q2a-0920000000-1c37180402c51b6574d7
Source of Spectrum O8-0-297-0
Synonyms 11,13,14-Trihydroxy-2,12-dimethoxypicras-2-ene-1,16-dione Nigakilactone H Phenanthro(10,1-bc)pyran-5,11(1H,4H)-dione, 2,3,3a,6a.beta.,7,7a.alpha.,8,11a,11b.alpha.,11c-decahydro-1.alpha.,3.beta.,3a.beta.-trihydroxy-2.beta.,10-dimethoxy-3,8.alpha.,11a.beta.,11cb.eta.-tetramethyl-
Wiley ID 1379230