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Virgaurin A

View entire compound with spectra: 1 MS (GC)

Virgaurin A
SpectraBase Compound ID EUmSMSLvHwh
InChI InChI=1S/C30H34O4/c1-7-9-11-13-21-19(5)25(23-17(3)15-33-29(23)27(21)31)26-20(6)22(14-12-10-8-2)28(32)30-24(26)18(4)16-34-30/h7-10,15-16,31-32H,11-14H2,1-6H3/b9-7+,10-8+
InChIKey SDUWIOYLRQJRAG-FIFLTTCUSA-N
Mol Weight 458.6 g/mol
Molecular Formula C30H34O4
Exact Mass 458.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOmgDVJtDqw
Name Virgaurin A
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H34O4
InChI InChI=1S/C30H34O4/c1-7-9-11-13-21-19(5)25(23-17(3)15-33-29(23)27(21)31)26-20(6)22(14-12-10-8-2)28(32)30-24(26)18(4)16-34-30/h7-10,15-16,31-32H,11-14H2,1-6H3/b9-7+,10-8+
InChIKey SDUWIOYLRQJRAG-FIFLTTCUSA-N
Molecular Weight 458.598 g/mol
SMILES Oc1c2c(c(-c3c(c(c(c4c3c(co4)C)O)CC\C=C\C)C)c(c1CC\C=C\C)C)c(co2)C
SPLASH splash10-0zfr-0011900000-8eb5a1e73ce5af39d6a3
Source of Spectrum Y1-35-1306-0
Wiley ID 1526860