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1,2,7-Naphthalenetriol, 5-(1,5-dimethyl-4-hexenyl)-5,6,7,8-tetrahydro-8-(hydroxymethyl)-3-methyl-, [5S-[5.alpha.(R*),7.alpha.,8.beta.]]-
SpectraBase Compound ID 4vArPXZuCgG
InChI InChI=1S/C20H30O4/c1-11(2)6-5-7-12(3)14-9-17(22)16(10-21)18-15(14)8-13(4)19(23)20(18)24/h6,8,12,14,16-17,21-24H,5,7,9-10H2,1-4H3/t12?,14-,16+,17-/m0/s1
InChIKey ZBGOKIQGJBSXMG-ANJKAXJUSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FOONgiZ3bp
Name 1,2,7-Naphthalenetriol, 5-(1,5-dimethyl-4-hexenyl)-5,6,7,8-tetrahydro-8-(hydroxymethyl)-3-methyl-, [5S-[5.alpha.(R*),7.alpha.,8.beta.]]-
CAS Registry Number 80144-93-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-11(2)6-5-7-12(3)14-9-17(22)16(10-21)18-15(14)8-13(4)19(23)20(18)24/h6,8,12,14,16-17,21-24H,5,7,9-10H2,1-4H3/t12?,14-,16+,17-/m0/s1
InChIKey ZBGOKIQGJBSXMG-ANJKAXJUSA-N
Molecular Weight 334.456 g/mol
SMILES OC[C@@]1([C@](C[C@](c2c1c(c(c(c2)C)O)O)(C(CCC=C(C)C)C)[H])(O)[H])[H]
SPLASH splash10-004i-0953000000-b61fbc5d53dbd1c93c1f
Source of Spectrum B-34-1957-0
Synonyms (2S)-Serrulat-14-ene-2,7,8,20-tetraol (5S,7S,8R)-5-(1,5-dimethyl-4-hexenyl)-8-(hydroxymethyl)-3-methyl-5,6,7,8-tetrahydro-1,2,7-naphthalenetriol
Wiley ID 1331108