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

*Links on SpectraBase are not permalinks.

SONGARICALARIN_A;(1-S,2-R,3-S,3A-R,5-S,6-R,7-S,7A-S)-2-[(2-METHYLBUTANOYL)-OXY]-1-(1-ALPHA-ACETOXYETHYL)-OCTAHYDRO-3,6-BISHYDROXY-

Compound with spectra: 1 NMR, and 1 MS (GC)

SONGARICALARIN_A;(1-S,2-R,3-S,3A-R,5-S,6-R,7-S,7A-S)-2-[(2-METHYLBUTANOYL)-OXY]-1-(1-ALPHA-ACETOXYETHYL)-OCTAHYDRO-3,6-BISHYDROXY-
SpectraBase Compound ID 8r9lv4PSwIc
InChI InChI=1S/C28H42O9/c1-9-13(3)11-18(30)36-25-15(5)19-21(22(24(25)32)28(8)12-34-28)20(16(6)35-17(7)29)26(23(19)31)37-27(33)14(4)10-2/h11,14,16,19-26,31-32H,5,9-10,12H2,1-4,6-8H3/b13-11+/t14?,16-,19+,20-,21+,22+,23+,24-,25+,26-,28-/m1/s1
InChIKey ABZABIRGUJABNL-XNYNQRQHSA-N
Mol Weight 522.6 g/mol
Molecular Formula C28H42O9
Exact Mass 522.282883 g/mol
Enantiomer InChIKey ABZABIRGUJABNL-WSBPGFMFSA-N

View Spectrum of SONGARICALARIN_A;(1-S,2-R,3-S,3A-R,5-S,6-R,7-S,7A-S)-2-[(2-METHYLBUTANOYL)-OXY]-1-(1-ALPHA-ACETOXYETHYL)-OCTAHYDRO-3,6-BISHYDROXY-

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum G4-76-309-1

View Spectrum of SONGARICALARIN_A;(1-S,2-R,3-S,3A-R,5-S,6-R,7-S,7A-S)-2-[(2-METHYLBUTANOYL)-OXY]-1-(1-ALPHA-ACETOXYETHYL)-OCTAHYDRO-3,6-BISHYDROXY-

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent ACETONE-D6
  • acetoxyethyl)octahydro-3,6-bishydroxy-4-methylidene-7-[(2S)-2-methyloxiran-2-yl]-1H-inden-5-yl(2E)-3-methylpent-2-enoate
HYPOCHOEROSIDE F
HYPOCHOEROSIDE E
EUPHOCHARACIN_G
FRPLQWPAMFUPFL-VKYBHKCNSA-N
Estra-1,3,5(10)-triene-11,17-diol, 3-methoxy-, bis(trifluoroacetate), (11.alpha.,17.beta.)-
TRICORNOSE_I;3-O-(E)-3,4,5-TRIMETHOXYCINNAMOYL-[4-O-(E)-SINAPOYL]-BETA-D-FRUCTOFURANOSYL-(2->1)]-[BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOS
5-{p-[(-)-2,3:4,6-di-O-isopropylidene-L-gulo-hex-2-ulofuranosonamido]phenyl}-10,20-diphenylporphyrin
20-[(6',6'-Dimethylbicyclo[3.1.1]hept-2-en-2-y)lhydroxymethyl]mestranol
RJFAQKCBKAPACU-IHBGUGEVSA-N
ANSAMITOCIN-P-3
Title Journal or Book Year
Songaricalarins A–E, Cytotoxic Oplopane Sesquiterpenes from Ligularia songarica Journal of Natural Products 2012
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.