![28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-QUINOVOPYRANOSYL]-GYPSOGENIN-ESTER](/api/spectrum/9XsLXBxm4zO/structure.png?h=300&w=458 "28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-QUINOVOPYRANOSYL]-GYPSOGENIN-ESTER")
| SpectraBase Compound ID | 4pBczB2913n |
|---|---|
| InChI | InChI=1S/C53H84O20/c1-23-32(57)35(60)38(63)44(67-23)71-41-33(58)24(2)68-46(42(41)72-45-39(64)36(61)40(25(3)69-45)70-43-37(62)34(59)28(55)21-66-43)73-47(65)53-18-16-48(4,5)20-27(53)26-10-11-30-49(6)14-13-31(56)50(7,22-54)29(49)12-15-52(30,9)51(26,8)17-19-53/h10,22-25,27-46,55-64H,11-21H2,1-9H3/t23-,24-,25+,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 | LRQOGAKNGAAJLY-RWYLNOAXSA-N |
| Mol Weight | 1041.2 g/mol |
| Molecular Formula | C53H84O20 |
| Exact Mass | 1040.555595 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 | 9XsLXBxm4zO |
|---|---|
| Name | 28-O-[XYLOPYRANOSYL-(1->4)-RHAMNOPYRANOSYL-(1->2)-[RHAMNOPYRANOSYL-(1->3)]-QUINOVOPYRANOSYL]-GYPSOGENIN-ESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H84O20 |
| InChI | InChI=1S/C53H84O20/c1-23-32(57)35(60)38(63)44(67-23)71-41-33(58)24(2)68-46(42(41)72-45-39(64)36(61)40(25(3)69-45)70-43-37(62)34(59)28(55)21-66-43)73-47(65)53-18-16-48(4,5)20-27(53)26-10-11-30-49(6)14-13-31(56)50(7,22-54)29(49)12-15-52(30,9)51(26,8)17-19-53/h10,22-25,27-46,55-64H,11-21H2,1-9H3/t23-,24-,25+,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 | LRQOGAKNGAAJLY-RWYLNOAXSA-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 | 1041.238 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN1337 |