#3;CALYSOLIN-XII;11S-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(3-O-TIGLOYL)-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[2-O-(2S)-METHYLBUTYRYL,4-O-TIGLOYL]-ALP
Compound with spectra: 1 NMR
![#3;CALYSOLIN-XII;11S-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(3-O-TIGLOYL)-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[2-O-(2S)-METHYLBUTYRYL,4-O-TIGLOYL]-ALP](/api/compound/2kC2yjHIVdX.png?ph=true&h=300&w=458 "#3;CALYSOLIN-XII;11S-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(3-O-TIGLOYL)-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[2-O-(2S)-METHYLBUTYRYL,4-O-TIGLOYL]-ALP")
| SpectraBase Compound ID | 2kC2yjHIVdX |
|---|---|
| InChI | InChI=1S/C67H110O33/c1-10-14-20-23-35-24-21-18-16-15-17-19-22-25-40(72)92-54-47(79)43(75)37(27-69)89-65(54)97-52-44(76)38(28-70)90-67(98-55-46(78)41(73)33(8)85-64(55)87-35)57(52)100-66-58(95-61(84)32(7)13-4)56(50(34(9)86-66)93-59(82)30(5)11-2)99-63-49(81)53(94-60(83)31(6)12-3)51(39(29-71)91-63)96-62-48(80)45(77)42(74)36(26-68)88-62/h11-12,32-39,41-58,62-71,73-81H,10,13-29H2,1-9H3/b30-11+,31-12+/t32-,33-,34+,35-,36+,37-,38+,39-,41-,42+,43-,44+,45-,46+,47+,48+,49-,50+,51-,52-,53-,54-,55-,56-,57+,58-,62-,63+,64+,65+,66+,67-/m0/s1 |
| InChIKey | GCIWMVPBTSHDRL-NTJKCCOBSA-N |
| Mol Weight | 1443.6 g/mol |
| Molecular Formula | C67H110O33 |
| Exact Mass | 1442.692936 g/mol |
| Enantiomer InChIKey | GCIWMVPBTSHDRL-WQYFMKDFSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | C5D5N |
CALYSOLIN_IV;11-S-JALAPINOLIC_ACID_11-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(3-O-TIGLOYL)-BETA-D-GLUCOPYRANOSYL-(1->3)-O-(2-O-2-S-METHYL
#2;CALYSOLIN-XI;11S-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->4)-O-(2-O-TIGLOYL)-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[2-O-(2S)-METHYLBUTYRYL,4-O-TIGLOYL]-ALPH
#2;CALYSOLIN-VI;(11S)-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-[2-O-(2S)-METHYLBUTYRYL,4-O-TIGLOYL]-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[O-[2-O-(2S)-MET
#4;CALYSOLIN-XVII;11S-JALAPINOLIC-ACID-11-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-(2-O-2S-METHYLBUTYRYL-4-O-TIGLOYL)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[O-BETA-D-GLUCOPYR
CALYSOLIN_III;11-S-JALAPINOLIC_ACID_11-O-(3-O-2-S,3-S-NILOYL,4-O-TIGLOYL)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[O-BETA-D-GLUCOPYRANOSYL-
#2;CALYSOLIN-XV;11S-JALAPINOLATE-11-O-BETA-D-GLUCOPYRANOSYL-(1->3)-O-(2-O-2S-METHYLBUTYRYL)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-[O-BETA-D-GLUCOPYRANOSYL-(1->6)-O-(3
#2;QM-2;METHYL-(3S,11S)-DIHYDROXY-TETRADECANOATE-11-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-(4-O-TIGLOYL)-BETA-D-QUINOVOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1-
#3;QM-3;METHYL-(3S,11S)-DIHYDROXY-TETRADECANOATE-11-O-BETA-D-FUCOPYRANOSYL-(1->3)-O-(4-O-TIGLOYL)-BETA-D-QUINOVOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->3)
#1;QM-6;METHYL-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-(4-O-TIGLOYL)-BETA-D-QUINOVOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[O-[4-O-(2R,3R)-NILOYL]-BETA-D-QUIN
PM-4;METHYL_3-S,11-S-DIHYDROXYTETRADECANOATE_11-O-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-O-[4-O-2-R-METHYL-3-R-O-(2-R-METHYL-3-R-HYDROXYBUTYRYL)-BUTYRYL]
| Title | Journal or Book | Year |
|---|---|---|
| Calysolins X–XIII, Resin Glycosides from <i>Calystegia soldanella</i>, and Their Antiviral Activity toward Herpes Simplex Virus | Chemical and Pharmaceutical Bulletin | 2014 |