| SpectraBase Compound ID | GiQzMXTASY1 |
|---|---|
| InChI | InChI=1S/C73H118O38/c1-26-54(106-62-53(94)55(33(79)24-99-62)107-59-48(89)40(81)29(75)20-96-59)52(93)58(109-61-50(91)42(83)31(77)22-98-61)65(102-26)110-57-47(88)44(85)34(19-74)103-66(57)111-67(95)73-16-15-68(2,3)17-28(73)27-9-10-37-70(6)13-12-39(69(4,5)36(70)11-14-71(37,7)72(27,8)18-38(73)80)105-63-51(92)46(87)45(86)35(104-63)25-101-64-56(43(84)32(78)23-100-64)108-60-49(90)41(82)30(76)21-97-60/h9,26,28-66,74-94H,10-25H2,1-8H3/t26-,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-,62-,63-,64-,65-,66-,70-,71+,72+,73+/m0/s1 |
| InChIKey | ZZIUZRZKFUITDR-NTFKVUCHSA-N |
| Mol Weight | 1603.7 g/mol |
| Molecular Formula | C73H118O38 |
| Exact Mass | 1602.730109 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 69AWb1GxouI |
|---|---|
| Name | GLEDITSIOSIDE-K;3-O-BETA-D-XYLOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-(1->6)-BETA-D-GLUCOPYRANOSYL-ECHINOCYSTIC-ACID-28-O-BETA-D-XYLOPYRANOSYL-( |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C73H118O38 |
| InChI | InChI=1S/C73H118O38/c1-26-54(106-62-53(94)55(33(79)24-99-62)107-59-48(89)40(81)29(75)20-96-59)52(93)58(109-61-50(91)42(83)31(77)22-98-61)65(102-26)110-57-47(88)44(85)34(19-74)103-66(57)111-67(95)73-16-15-68(2,3)17-28(73)27-9-10-37-70(6)13-12-39(69(4,5)36(70)11-14-71(37,7)72(27,8)18-38(73)80)105-63-51(92)46(87)45(86)35(104-63)25-101-64-56(43(84)32(78)23-100-64)108-60-49(90)41(82)30(76)21-97-60/h9,26,28-66,74-94H,10-25H2,1-8H3/t26-,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-,62-,63-,64-,65-,66-,70-,71+,72+,73+/m0/s1 |
| InChIKey | ZZIUZRZKFUITDR-NTFKVUCHSA-N |
| Literature Reference Author | Z.ZHANG,K.KOIKE,Z.JIA,T.NIKAIDO,D.GUO,J.ZHENG |
| Literature Reference Citation | PHYTOCHEM.,52,715(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00238-1 |
| Molecular Weight | 1603.717 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN484 |