SECO-XESTOVANIN-A
Compound with spectra: 1 NMR
| SpectraBase Compound ID | FT6Iy3Bhkgv |
|---|---|
| InChI | InChI=1S/C42H68O12/c1-22(2)13-17-30(43)24(5)16-20-33(45)42(10)21-11-12-29(42)26(7)31(44)18-15-25(6)32(19-14-23(3)4)53-40-38(50)36(48)39(28(9)52-40)54-41-37(49)35(47)34(46)27(8)51-41/h13-16,26-30,32,34-41,43,46-50H,11-12,17-21H2,1-10H3/b24-16+,25-15+/t26-,27+,28+,29?,30?,32?,34+,35-,36+,37-,38+,39-,40-,41+,42-/m0/s1 |
| InChIKey | AYAPNMKZGPQYJA-IPGFLMBBSA-N |
| Mol Weight | 765.0 g/mol |
| Molecular Formula | C42H68O12 |
| Exact Mass | 764.471078 g/mol |
| Enantiomer InChIKey | AYAPNMKZGPQYJA-RJSCAUJFSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
LIGUROBUSTOSIDE-N;[2-(4-HYDROXYPHENYLETHYL)]-[3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-(4-O-CAFFEOYL)-BETA-D-GLUCOPYRANOSIDE
#1;CAPSIANOSIDE-III;3-O-BETA-D-GLUCOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-17-HYDROXY-6E,10E,14Z-(3S)-GERANYLLINALOOL-17-O-BETA-D-GLUCOPYRANOSYL-(1->2)-[ALPHA-
LOQUATIFOLIN A
NEROLIDOL-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
4'''''-O-ACETYL-MUKUROZIOSIDE-IIA
4''-O-ACETYL-MUKUROZIOSIDE-IIA
#3;CAPSIANOSIDE-XV;3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-BETA-D-GLUCOPYRANOSYL-17,19-DIHYDROXY-6-E,10-E,14-Z-(3S)-GERANYLLINALOOL-17-ALPHA-L-RHAMNOPYRANOSYL-(1->4
PESCAPROSIDE_A;(11-S)-HYDROXYHEXADECANOATE_11-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->4)]-O-[2-O-N-DODECANOYL]-ALPHA-L-RHAM
#3;QUAMOCLIN-VII;11S-CONVOLVULINOLATE-11-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[4-O-2S-METHYLBUTYRYL-ALPHA-L-RHAMNOPYRANOSYL-(1->4)]-O-ALPHA-L-RHAMNOPYRANOSYL-(1-4)
#18;3-AMINOPROPYL_BETA-D-GALACTOPYRANOSYL-(1-3)-2-ACETAMIDO-2-DEOXY-BETA-D-GALACTOPYRANOSYL-(1-3)-ALPHA-D-GALACTOPYRANOSYL-(1-4)-BETA-D-GALACTOPYRANOSYL-(1-4)-
| Title | Journal or Book | Year |
|---|---|---|
| Xestovanin A and secoxestovanin A, triterpenoid glycosides with new carbon skeletons from the sponge Xestospongia vanilla | Journal of the American Chemical Society | 1989 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.