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1-Naphthalenecarboxylic acid, decahydro-4-hydroxy-4a-methyl-7-(1-methylethyl)-8-[(1-oxo-3-phenyl-2- propenyl)oxy]-, methyl ester, [1S-(1.alpha.,4.beta.,4a.alpha.,7.alpha.,8.alpha.,8a.beta.)]-
SpectraBase Compound ID FZR0eIXxqCo
InChI InChI=1S/C25H34O5/c1-16(2)18-14-15-25(3)20(26)12-11-19(24(28)29-4)22(25)23(18)30-21(27)13-10-17-8-6-5-7-9-17/h5-10,13,16,18-20,22-23,26H,11-12,14-15H2,1-4H3/b13-10-/t18-,19-,20-,22+,23+,25-/m0/s1
InChIKey MYUACHJYYCBZTB-JMRZOFMNSA-N
Mol Weight 414.5 g/mol
Molecular Formula C25H34O5
Exact Mass 414.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eu6WcY79nPn
Name 1-Naphthalenecarboxylic acid, decahydro-4-hydroxy-4a-methyl-7-(1-methylethyl)-8-[(1-oxo-3-phenyl-2- propenyl)oxy]-, methyl ester, [1S-(1.alpha.,4.beta.,4a.alpha.,7.alpha.,8.alpha.,8a.beta.)]-
Alternate Name(s) Methyl 6.beta.-cinnamoyloxy-3.alpha.-hydroxyeudesman-14-carboxylate Methyl (1S,4S,4aR,7S,8R,8aS)-4-hydroxy-7-isopropyl-4a-methyl-8-{[(2Z)-3-phenyl-2-propenoyl]oxy}decahydro-1-naphthalenecarboxylate Methyl 6.beta.-cinnamoyloxy-1.alpha.-hydroxyeudesman-14-carboxylate
CAS Registry Number 66148-39-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H34O5
InChI InChI=1S/C25H34O5/c1-16(2)18-14-15-25(3)20(26)12-11-19(24(28)29-4)22(25)23(18)30-21(27)13-10-17-8-6-5-7-9-17/h5-10,13,16,18-20,22-23,26H,11-12,14-15H2,1-4H3/b13-10-/t18-,19-,20-,22+,23+,25-/m0/s1
InChIKey MYUACHJYYCBZTB-JMRZOFMNSA-N
Molecular Weight 414.542 g/mol
SMILES O[C@@]1([C@]2([C@@]([C@@]([C@](C(C)C)(CC2)[H])(OC(\C=C/c2ccccc2)=O)[H])([C@@](C(=O)OC)(CC1)[H])[H])C)[H]
SPLASH splash10-001i-0900000000-a0a2136f81fc26cd646d
Source of Spectrum K-111-262-0
Wiley ID 1375544