| SpectraBase Compound ID | KOBWhvPV0XU |
|---|---|
| InChI | InChI=1S/C69H112O37/c1-24-36(78)40(82)44(86)57(97-24)102-49-31(76)19-93-56(46(49)88)101-48-25(2)98-59(47(89)50(48)103-61-53(90)68(92,22-72)23-96-61)104-51-37(79)30(75)18-94-60(51)106-62(91)69-12-11-63(3,4)13-27(69)26-9-10-34-64(5)14-29(74)54(65(6,21-71)52(64)28(73)15-67(34,8)66(26,7)16-35(69)77)105-58-45(87)42(84)39(81)33(100-58)20-95-55-43(85)41(83)38(80)32(17-70)99-55/h9,24-25,27-61,70-90,92H,10-23H2,1-8H3/t24-,25-,27-,28+,29-,30-,31+,32+,33+,34+,35+,36-,37-,38+,39+,40+,41-,42-,43+,44+,45+,46+,47+,48-,49-,50-,51+,52+,53-,54-,55+,56-,57-,58-,59-,60-,61-,64+,65-,66+,67+,68+,69+/m0/s1 |
| InChIKey | AKOMXOYIMMPQRS-XGDOQVLQSA-N |
| Mol Weight | 1533.6 g/mol |
| Molecular Formula | C69H112O37 |
| Exact Mass | 1532.688245 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Iy3OzU5Wl82 |
|---|---|
| Name | #3;3-O-(BETA-D-GLUCOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL)-28-O-(ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-[BETA-D-APIOFURANOSYL-(1->3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C69H112O37 |
| InChI | InChI=1S/C69H112O37/c1-24-36(78)40(82)44(86)57(97-24)102-49-31(76)19-93-56(46(49)88)101-48-25(2)98-59(47(89)50(48)103-61-53(90)68(92,22-72)23-96-61)104-51-37(79)30(75)18-94-60(51)106-62(91)69-12-11-63(3,4)13-27(69)26-9-10-34-64(5)14-29(74)54(65(6,21-71)52(64)28(73)15-67(34,8)66(26,7)16-35(69)77)105-58-45(87)42(84)39(81)33(100-58)20-95-55-43(85)41(83)38(80)32(17-70)99-55/h9,24-25,27-61,70-90,92H,10-23H2,1-8H3/t24-,25-,27-,28+,29-,30-,31+,32+,33+,34+,35+,36-,37-,38+,39+,40+,41-,42-,43+,44+,45+,46+,47+,48-,49-,50-,51+,52+,53-,54-,55+,56-,57-,58-,59-,60-,61-,64+,65-,66+,67+,68+,69+/m0/s1 |
| InChIKey | AKOMXOYIMMPQRS-XGDOQVLQSA-N |
| Literature Reference Author | A.SANCHEZ-MEDINA,P.C.STEVENSON,S.HABTEMARIAM,L.M.PENA-RODRIG UEZ,O.CORCORAN,A.I.M |
| Literature Reference Citation | PHYTOCHEM.,70,765(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.03.014 |
| Molecular Weight | 1533.626 g/mol |
| Sample ID | 64676 |
| Solvent | CD3OD |