![SANICULASAPONIN-II;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-21-O-ACETYL-22-O-ANGELOYL-3-BETA,](/api/spectrum/JqESurLwkC1/structure.png?h=300&w=458 "SANICULASAPONIN-II;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-21-O-ACETYL-22-O-ANGELOYL-3-BETA,")
| SpectraBase Compound ID | KUWaJZp1oZr |
|---|---|
| InChI | InChI=1S/C54H84O23/c1-11-22(2)45(69)77-42-43(71-23(3)57)54(21-56)25(18-49(42,4)5)24-12-13-29-51(8)16-15-30(50(6,7)28(51)14-17-52(29,9)53(24,10)40(65)41(54)66)73-48-39(76-47-35(63)33(61)32(60)27(19-55)72-47)37(36(64)38(75-48)44(67)68)74-46-34(62)31(59)26(58)20-70-46/h11-12,25-43,46-48,55-56,58-66H,13-21H2,1-10H3,(H,67,68)/b22-11-/t25?,26-,27+,28?,29?,30-,31-,32+,33-,34+,35+,36-,37-,38-,39+,40-,41+,42-,43-,46-,47-,48+,51-,52+,53-,54-/m0/s1 |
| InChIKey | OPRUBZSIDMHCMS-YZDYZYAGSA-N |
| Mol Weight | 1101.2 g/mol |
| Molecular Formula | C54H84O23 |
| Exact Mass | 1100.540339 g/mol |
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| SpectraBase Spectrum ID | JqESurLwkC1 |
|---|---|
| Name | SANICULASAPONIN-II;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL-21-O-ACETYL-22-O-ANGELOYL-3-BETA, |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H84O23 |
| InChI | InChI=1S/C54H84O23/c1-11-22(2)45(69)77-42-43(71-23(3)57)54(21-56)25(18-49(42,4)5)24-12-13-29-51(8)16-15-30(50(6,7)28(51)14-17-52(29,9)53(24,10)40(65)41(54)66)73-48-39(76-47-35(63)33(61)32(60)27(19-55)72-47)37(36(64)38(75-48)44(67)68)74-46-34(62)31(59)26(58)20-70-46/h11-12,25-43,46-48,55-56,58-66H,13-21H2,1-10H3,(H,67,68)/b22-11-/t25?,26-,27+,28?,29?,30-,31-,32+,33-,34+,35+,36-,37-,38-,39+,40-,41+,42-,43-,46-,47-,48+,51-,52+,53-,54-/m0/s1 |
| InChIKey | OPRUBZSIDMHCMS-YZDYZYAGSA-N |
| Literature Reference Author | A.MATSUSHITA,T.MIYASE,H.NOGUCHI,D.V.VELDE |
| Literature Reference Citation | J.NAT.PROD.,67,377(2004) |
| Literature Reference DOI | 10.1021/np030316v |
| Molecular Weight | 1101.247 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWKP4012 |