![#3;SAPONARIOSIDE-E;3-O-BETA-D-GLUCOPYRANOSYL-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1-2)-BETA-D-GLUCOPYRANOSYL-(1-6)-[BETA-D-GLUCOPYRANOSYL-(1-3)]-BETA-D-](/api/spectrum/GePr7F6JXtj/structure.png?h=300&w=458 "#3;SAPONARIOSIDE-E;3-O-BETA-D-GLUCOPYRANOSYL-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1-2)-BETA-D-GLUCOPYRANOSYL-(1-6)-[BETA-D-GLUCOPYRANOSYL-(1-3)]-BETA-D-")
| SpectraBase Compound ID | HfUylQrqNTJ |
|---|---|
| InChI | InChI=1S/C60H96O30/c1-55(2)13-15-60(16-14-57(4)23(24(60)17-55)7-8-30-56(3)11-10-32(59(6,53(78)79)31(56)9-12-58(30,57)5)87-48-42(74)38(70)33(65)25(18-61)82-48)54(80)90-51-45(77)46(88-49-43(75)39(71)34(66)26(19-62)83-49)37(69)29(86-51)22-81-52-47(41(73)36(68)28(21-64)85-52)89-50-44(76)40(72)35(67)27(20-63)84-50/h7,24-52,61-77H,8-22H2,1-6H3,(H,78,79)/t24-,25+,26-,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+,56+,57+,58+,59-,60-/m0/s1 |
| InChIKey | CXKSOBADZHLYSF-XPJLVMEFSA-N |
| Mol Weight | 1297.4 g/mol |
| Molecular Formula | C60H96O30 |
| Exact Mass | 1296.598642 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GePr7F6JXtj |
|---|---|
| Name | #3;SAPONARIOSIDE-E;3-O-BETA-D-GLUCOPYRANOSYL-GYPSOGENIC-ACID-28-O-BETA-D-GLUCOPYRANOSYL-(1-2)-BETA-D-GLUCOPYRANOSYL-(1-6)-[BETA-D-GLUCOPYRANOSYL-(1-3)]-BETA-D- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H96O30 |
| InChI | InChI=1S/C60H96O30/c1-55(2)13-15-60(16-14-57(4)23(24(60)17-55)7-8-30-56(3)11-10-32(59(6,53(78)79)31(56)9-12-58(30,57)5)87-48-42(74)38(70)33(65)25(18-61)82-48)54(80)90-51-45(77)46(88-49-43(75)39(71)34(66)26(19-62)83-49)37(69)29(86-51)22-81-52-47(41(73)36(68)28(21-64)85-52)89-50-44(76)40(72)35(67)27(20-63)84-50/h7,24-52,61-77H,8-22H2,1-6H3,(H,78,79)/t24-,25+,26-,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+,56+,57+,58+,59-,60-/m0/s1 |
| InChIKey | CXKSOBADZHLYSF-XPJLVMEFSA-N |
| Literature Reference Author | Z.JIA,K.KOIKE,T.NIKAIDO |
| Literature Reference Citation | J.NAT.PROD.,62,449(1999) |
| Literature Reference DOI | 10.1021/np980434w |
| Molecular Weight | 1297.404 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP7873 |