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7-hydroxy-1-[(E)-7-hydroxy-6-methylhept-5-en-2-yl]-3a-methyl-3,5,6,7,9,9a-hexahydrocyclopenta[b]chromen-8-one

View entire compound with spectra: 2 NMR

7-hydroxy-1-[(E)-7-hydroxy-6-methylhept-5-en-2-yl]-3a-methyl-3,5,6,7,9,9a-hexahydrocyclopenta[b]chromen-8-one
SpectraBase Compound ID KGo7DdYKKrh
InChI InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+
InChIKey KOATXBNOVXBDJE-WLRTZDKTSA-N
Mol Weight 346.47 g/mol
Molecular Formula C21H30O4
Exact Mass 346.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3a4J62qCSjY
Name ACTG-TOXINE 1 (FROM ALTERNARIA CITRI)
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C21H30O4
InChI InChI=1S/C21H30O4/c1-13(12-22)5-4-6-14(2)15-9-10-21(3)17(15)11-16-19(25-21)8-7-18(23)20(16)24/h5,9,14,17-18,22-23H,4,6-8,10-12H2,1-3H3/b13-5+
InChIKey KOATXBNOVXBDJE-WLRTZDKTSA-N
Instrument Name SEE COMMENT
Literature Reference S.I.SVIRIDOV, B.S.ERMOLINSKY, G.A.BELYAKOVA, V.G.DZHAVAKHIYA (1991)Khim.Prirodnykh Soed.(Russ. Lang.): N5, 642-648.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported