![16-EPI-SAIKOGENIN-C-28-O-BETA-GLUCOPYRANOSYL-3-O-BETA-GLUCOPYRANOSYL-(1->6)-[ALPHA-RHAMNOPYRANOSYL-(1->4)]-BETA-GLUCOPYRANOSIDE](/api/spectrum/LCF2PXVHBwK/structure.png?h=300&w=458 "16-EPI-SAIKOGENIN-C-28-O-BETA-GLUCOPYRANOSYL-3-O-BETA-GLUCOPYRANOSYL-(1->6)-[ALPHA-RHAMNOPYRANOSYL-(1->4)]-BETA-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | 9vgEl13j5Ns |
|---|---|
| InChI | InChI=1S/C54H88O22/c1-23-33(58)36(61)42(67)47(71-23)76-44-28(21-69-45-40(65)37(62)34(59)26(19-55)72-45)74-48(43(68)39(44)64)75-32-12-13-51(6)29(50(32,4)5)11-14-52(7)30(51)10-9-24-25-17-49(2,3)15-16-54(25,31(57)18-53(24,52)8)22-70-46-41(66)38(63)35(60)27(20-56)73-46/h9-10,23,26-48,55-68H,11-22H2,1-8H3/t23-,26-,27-,28-,29+,30-,31-,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43-,44-,45-,46-,47-,48+,51+,52-,53-,54-/m1/s1 |
| InChIKey | NEYNWYUAGIWYIY-ILDNBOMWSA-N |
| Mol Weight | 1089.3 g/mol |
| Molecular Formula | C54H88O22 |
| Exact Mass | 1088.576724 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LCF2PXVHBwK |
|---|---|
| Name | 16-EPI-SAIKOGENIN-C-28-O-BETA-GLUCOPYRANOSYL-3-O-BETA-GLUCOPYRANOSYL-(1->6)-[ALPHA-RHAMNOPYRANOSYL-(1->4)]-BETA-GLUCOPYRANOSIDE |
| Compound Number | BK3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H88O22 |
| InChI | InChI=1S/C54H88O22/c1-23-33(58)36(61)42(67)47(71-23)76-44-28(21-69-45-40(65)37(62)34(59)26(19-55)72-45)74-48(43(68)39(44)64)75-32-12-13-51(6)29(50(32,4)5)11-14-52(7)30(51)10-9-24-25-17-49(2,3)15-16-54(25,31(57)18-53(24,52)8)22-70-46-41(66)38(63)35(60)27(20-56)73-46/h9-10,23,26-48,55-68H,11-22H2,1-8H3/t23-,26-,27-,28-,29+,30-,31-,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43-,44-,45-,46-,47-,48+,51+,52-,53-,54-/m1/s1 |
| InChIKey | NEYNWYUAGIWYIY-ILDNBOMWSA-N |
| Literature Reference Author | S.Q.LUO,H.F.JIN,H.KAWAI,H.SETO,N.OTAKE |
| Literature Reference Citation | AGR.BIOL.CHEM.,51,1515(1987) |
| Literature Reference DOI | 10.1271/bbb1961.51.1515 |
| Molecular Weight | 1089.280 g/mol |
| Solvent | Unknown |
| Source File Reference | UWBT8143 |