For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Scupolin G

View entire compound with spectra: 1 MS (GC)

Scupolin G
SpectraBase Compound ID 7xxB0wshmGk
InChI InChI=1S/C26H38O9/c1-12(2)21(29)35-23-26-17(10-16(33-23)20(28)25(26)11-31-25)24(5,13(3)8-19(26)32-14(4)27)18-9-15-6-7-30-22(15)34-18/h12-13,15-20,22-23,28H,6-11H2,1-5H3/t13-,15-,16-,17-,18+,19+,20+,22+,23?,24+,25-,26+/m1/s1
InChIKey JRFTYJRNDOQDQK-VOPULGBPSA-N
Mol Weight 494.6 g/mol
Molecular Formula C26H38O9
Exact Mass 494.251583 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EuONbud7OTE
Name Scupolin G
Alternate Name(s) (1'R,2R,2'S,4'R,5'S,6'R,8'R,9'S)-5'-[(2S,3aR,6aS)-hexahydrofuro[2,3-b]furan-2-yl]-2'-(acetyloxy)-9'-hydroxy-4',5'-dimethyl-12'-oxaspiro[oxirane-2,10'-tricyclo[6.2.2.0(1,6)]dodecane]-11'-yl 2-methylpropanoate 6.alpha.-Acetoxy-19-[(isobutyryl)oxy]-2.alpha,19: 4.alpha.,18: 11,16: 15,16-tetraepoxy-neoclerodan-3.beta.-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O9
InChI InChI=1S/C26H38O9/c1-12(2)21(29)35-23-26-17(10-16(33-23)20(28)25(26)11-31-25)24(5,13(3)8-19(26)32-14(4)27)18-9-15-6-7-30-22(15)34-18/h12-13,15-20,22-23,28H,6-11H2,1-5H3/t13-,15-,16-,17-,18+,19+,20+,22+,23?,24+,25-,26+/m1/s1
InChIKey JRFTYJRNDOQDQK-VOPULGBPSA-N
Molecular Weight 494.581 g/mol
SMILES O[C@@]1([C@]2([C@]34C(OC(=O)C(C)C)O[C@@]1(C[C@@]4([C@]([C@]1(O[C@@]4(OCC[C@@]4(C1)[H])[H])[H])(C)[C@@](C[C@@]3(OC(=O)C)[H])(C)[H])[H])[H])OC2)[H]
SPLASH splash10-03xu-9610000000-e7afdef34f07d6edec57
Source of Spectrum G4-60-1234-9
Wiley ID 1606990