![#2;ILEKUDINOSIDE-A;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSYLESTER](/api/spectrum/6AKM1WRnxaC/structure.png?h=300&w=458 "#2;ILEKUDINOSIDE-A;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSYLESTER")
| SpectraBase Compound ID | Lk3z5BUc2Zr |
|---|---|
| InChI | InChI=1S/C53H86O21/c1-23-32(57)35(60)38(63)43(68-23)73-42-41(72-44-39(64)36(61)33(58)27(20-54)69-44)26(56)22-67-46(42)71-31-12-13-50(6)29(49(31,4)5)11-14-52(8)30(50)10-9-24-25-19-48(2,3)15-17-53(25,18-16-51(24,52)7)47(66)74-45-40(65)37(62)34(59)28(21-55)70-45/h9,23,25-46,54-65H,10-22H2,1-8H3/t23-,25-,26+,27-,28+,29?,30?,31-,32-,33-,34+,35+,36+,37-,38+,39-,40+,41+,42-,43+,44+,45-,46-,50-,51+,52+,53-/m0/s1 |
| InChIKey | ULSOTXJNUTYKRK-WVPUTLHASA-N |
| Mol Weight | 1059.2 g/mol |
| Molecular Formula | C53H86O21 |
| Exact Mass | 1058.56616 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6AKM1WRnxaC |
|---|---|
| Name | #2;ILEKUDINOSIDE-A;3-O-BETA-D-GLUCOPYRANOSYL-(1->3)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-OLEANOLIC-ACID-28-O-BETA-D-GLUCOPYRANOSYLESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H86O21 |
| InChI | InChI=1S/C53H86O21/c1-23-32(57)35(60)38(63)43(68-23)73-42-41(72-44-39(64)36(61)33(58)27(20-54)69-44)26(56)22-67-46(42)71-31-12-13-50(6)29(49(31,4)5)11-14-52(8)30(50)10-9-24-25-19-48(2,3)15-17-53(25,18-16-51(24,52)7)47(66)74-45-40(65)37(62)34(59)28(21-55)70-45/h9,23,25-46,54-65H,10-22H2,1-8H3/t23-,25-,26+,27-,28+,29?,30?,31-,32-,33-,34+,35+,36+,37-,38+,39-,40+,41+,42-,43+,44+,45-,46-,50-,51+,52+,53-/m0/s1 |
| InChIKey | ULSOTXJNUTYKRK-WVPUTLHASA-N |
| Literature Reference Author | K.NISHIMURA,T.MIYASE,H.NOGUCHI |
| Literature Reference Citation | J.NAT.PROD.,62,1128(1999) |
| Literature Reference DOI | 10.1021/np990128y |
| Molecular Weight | 1059.253 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWCP8731 |