![28-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->4)]-RHAMNOPYRANOSYL-(1->2)-FUCOPYRANOSYL]-GYPSOGENIN](/api/spectrum/3KQbVGYeWMt/structure.png?h=300&w=458 "28-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->4)]-RHAMNOPYRANOSYL-(1->2)-FUCOPYRANOSYL]-GYPSOGENIN")
| SpectraBase Compound ID | Hq3NAkSexaY |
|---|---|
| InChI | InChI=1S/C53H84O21/c1-23-32(58)36(62)42(73-45-39(65)41(72-44-38(64)35(61)34(60)28(20-54)70-44)40(24(2)69-45)71-43-37(63)33(59)27(56)21-67-43)46(68-23)74-47(66)53-17-15-48(3,4)19-26(53)25-9-10-30-49(5)13-12-31(57)50(6,22-55)29(49)11-14-52(30,8)51(25,7)16-18-53/h9,22-24,26-46,54,56-65H,10-21H2,1-8H3/t23-,24+,26?,27-,28+,29?,30?,31+,32+,33+,34+,35-,36+,37-,38+,39-,40+,41+,42-,43+,44-,45+,46+,49+,50+,51-,52-,53+/m1/s1 |
| InChIKey | YVYXWIJADGXWAF-ICWAQOPRSA-N |
| Mol Weight | 1057.2 g/mol |
| Molecular Formula | C53H84O21 |
| Exact Mass | 1056.55051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3KQbVGYeWMt |
|---|---|
| Name | 28-O-BETA-[GLUCOPYRANOSYL-(1->3)-[XYLOPYRANOSYL-(1->4)]-RHAMNOPYRANOSYL-(1->2)-FUCOPYRANOSYL]-GYPSOGENIN |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H84O21 |
| InChI | InChI=1S/C53H84O21/c1-23-32(58)36(62)42(73-45-39(65)41(72-44-38(64)35(61)34(60)28(20-54)70-44)40(24(2)69-45)71-43-37(63)33(59)27(56)21-67-43)46(68-23)74-47(66)53-17-15-48(3,4)19-26(53)25-9-10-30-49(5)13-12-31(57)50(6,22-55)29(49)11-14-52(30,8)51(25,7)16-18-53/h9,22-24,26-46,54,56-65H,10-21H2,1-8H3/t23-,24+,26?,27-,28+,29?,30?,31+,32+,33+,34+,35-,36+,37-,38+,39-,40+,41+,42-,43+,44-,45+,46+,49+,50+,51-,52-,53+/m1/s1 |
| InChIKey | YVYXWIJADGXWAF-ICWAQOPRSA-N |
| Literature Reference Author | N.TAN,J.ZHOU,S.ZHAO |
| Literature Reference Citation | PHYTOCHEM.,52,153(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(98)00454-3 |
| Molecular Weight | 1057.237 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1099 |