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STYPANDROL
SpectraBase Compound ID 9SBiiCc34vQ
InChI InChI=1S/C26H22O6/c1-11-9-15-5-7-17(23(29)21(15)25(31)19(11)13(3)27)18-8-6-16-10-12(2)20(14(4)28)26(32)22(16)24(18)30/h5-10,29-32H,1-4H3
InChIKey GCLHKQZTLUKUTE-UHFFFAOYSA-N
Mol Weight 430.46 g/mol
Molecular Formula C26H22O6
Exact Mass 430.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KO76LOqH1sN
Name 1-[7-(7-acetyl-1,8-dihydroxy-6-methyl-2-naphthalenyl)-1,8-dihydroxy-3-methyl-2-naphthalenyl]ethanone
CAS Registry Number 99305-33-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H22O6
InChI InChI=1S/C26H22O6/c1-11-9-15-5-7-17(23(29)21(15)25(31)19(11)13(3)27)18-8-6-16-10-12(2)20(14(4)28)26(32)22(16)24(18)30/h5-10,29-32H,1-4H3
InChIKey GCLHKQZTLUKUTE-UHFFFAOYSA-N
Molecular Weight 430.456 g/mol
SMILES Oc1c(-c2ccc3cc(c(c(c3c2O)O)C(=O)C)C)ccc2cc(c(c(c12)O)C(=O)C)C
SPLASH splash10-001i-0040900000-c7abeccdd15af7e149f4
Source of Spectrum B-41-1097-1
Synonyms 1-[7-(7-acetyl-1,8-dihydroxy-6-methyl-2-naphthyl)-1,8-dihydroxy-3-methyl-2-naphthyl]ethanone 1-[7-(7-acetyl-1,8-dihydroxy-6-methylnaphthalen-2-yl)-1,8-dihydroxy-3-methylnaphthalen-2-yl]ethanone 1-[7-[7-ethanoyl-6-methyl-1,8-bis(oxidanyl)naphthalen-2-yl]-3-methyl-1,8-bis(oxidanyl)naphthalen-2-yl]ethanone Hemerocallin Stypandrol
Wiley ID 1381641