PURGINOSIDE_I
Compound with spectra: 1 NMR
| SpectraBase Compound ID | GftTalIJGvy |
|---|---|
| InChI | InChI=1S/C70H112O26/c1-9-12-14-15-17-21-29-35-48(73)91-64-63(96-66-54(79)52(77)51(76)46(38-71)88-66)59(94-68-61(90-49(74)37-36-44-30-25-23-26-31-44)55(80)57(41(6)84-68)92-65(82)39(4)11-3)43(8)86-70(64)93-58-42(7)85-69-62(56(58)81)89-47(72)34-28-22-19-16-18-20-27-33-45(32-24-13-10-2)87-67-60(95-69)53(78)50(75)40(5)83-67/h23,25-26,30-31,36-37,39-43,45-46,50-64,66-71,75-81H,9-22,24,27-29,32-35,38H2,1-8H3/b37-36+/t39?,40-,41+,42+,43+,45+,46+,50+,51+,52-,53+,54+,55-,56-,57+,58+,59+,60-,61-,62-,63-,64-,66-,67+,68+,69+,70+/m1/s1 |
| InChIKey | MFVVQPJPHUAJBA-QDSHDPGNSA-N |
| Mol Weight | 1369.6 g/mol |
| Molecular Formula | C70H112O26 |
| Exact Mass | 1368.744184 g/mol |
| Enantiomer InChIKey | MFVVQPJPHUAJBA-HXBKGLFPSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | C5D5N |
#2;PESCAPREIN_XI;(11-S)-O-HEXADECANOIC_ACID-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-[2-O-(TRANS-CINNAMOYL)-4-O-(2S-METHYLBUTANOYL)-ALPHA-L-RHAMNOPYRANOSYL]
#8;PESCAPREIN_XVII;(11-S)-O-HEXADECANOIC_ACID-3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-4-O-[2-O-(TRANS-CINNAMYOL)-4-O-(2S-METHYLBUTANOYL)-ALPHA-L-RHAMNOPYRANOSYL]
#2;(11S)-[[O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-[(2-O-(TRANS)-CINNAMOYL)-(4-O-ISOBUTANOYL)-ALPHA-L-RHAMNOPYRANOSYL-(1->4)]-O-2-O-(2S)-METHYLBUTHANOYL-ALPH
#4;(11S)-[[O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-[(2-O-(TRANS)-CINNAMOYL)-(4-O-N-DODECANOYL)-ALPHA-L-RHAMNOPYRANOSYL-(1->4)]-O-2-O-(2S)-METHYLBUTHANOYL-ALP
PESCAPREIN_XXIV;(11-S)-JALAPINOLIC_ACID_11-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-
MURUCOIDIN_IV
INTRAPILOSIN_VI
PURGINOSIDE_II
INTRAPILOSIN_III
INTRAPILOSIN_VII
| Title | Journal or Book | Year |
|---|---|---|
| Resin Glycosides from the Herbal Drug Jalap (Ipomoea purga) | Journal of Natural Products | 2011 |
This compound is available in the following databases:
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.