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SEMI-VIRIDITOXIN
SpectraBase Compound ID 4lBfVrjJBu5
InChI InChI=1S/C17H16O7/c1-22-10-4-8-3-9-5-11(7-13(19)23-2)24-17(21)15(9)16(20)14(8)12(18)6-10/h3-4,6,11,18,20H,5,7H2,1-2H3/t11-/m0/s1
InChIKey CVDVPYTVGZWTON-NSHDSACASA-N
Mol Weight 332.31 g/mol
Molecular Formula C17H16O7
Exact Mass 332.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AFEDRTHdbC
Name 2-[(3S)-9,10-dihydroxy-1-keto-7-methoxy-3,4-dihydrobenz[g]isochromen-3-yl]acetic acid methyl ester
Alternate Name(s) 2-[(3S)-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydrobenzo[g][2]benzopyran-3-yl]acetic acid methyl ester Methyl 2-[(3S)-7-methoxy-9,10-bis(oxidanyl)-1-oxidanylidene-3,4-dihydrobenzo[g]isochromen-3-yl]ethanoate Methyl 2-[(3S)-9,10-dihydroxy-7-methoxy-1-oxo-3,4-dihydrobenzo[g]isochromen-3-yl]acetate
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Formula C17H16O7
InChI InChI=1S/C17H16O7/c1-22-10-4-8-3-9-5-11(7-13(19)23-2)24-17(21)15(9)16(20)14(8)12(18)6-10/h3-4,6,11,18,20H,5,7H2,1-2H3/t11-/m0/s1
InChIKey CVDVPYTVGZWTON-NSHDSACASA-N
Molecular Weight 332.308 g/mol
SMILES Oc1c2c(cc(cc2cc2C[C@](OC(c12)=O)(CC(=O)OC)[H])OC)O
SPLASH splash10-001i-0039000000-cf2ce613e94034ed482d
Source of Spectrum I-69-191-1
Wiley ID 1329264