![NIGRUMNIN-I;TIGOGENIN-3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[ALPHA-L-ARABINOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2](/api/spectrum/HZ8yzSuMkgA/structure.png?h=300&w=458 "NIGRUMNIN-I;TIGOGENIN-3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[ALPHA-L-ARABINOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2")
| SpectraBase Compound ID | 8AfdoFe6djR |
|---|---|
| InChI | InChI=1S/C55H90O25/c1-21-8-13-55(71-18-21)22(2)34-31(80-55)15-28-26-7-6-24-14-25(9-11-53(24,4)27(26)10-12-54(28,34)5)73-51-46(78-50-42(67)39(64)35(60)23(3)72-50)43(68)44(33(17-57)75-51)76-52-47(79-49-41(66)37(62)30(59)20-70-49)45(38(63)32(16-56)74-52)77-48-40(65)36(61)29(58)19-69-48/h21-52,56-68H,6-20H2,1-5H3/t21-,22+,23+,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42-,43+,44+,45+,46-,47-,48+,49+,50+,51-,52+,53+,54+,55-/m1/s1 |
| InChIKey | YYCFEJVBMMGRLX-HZSDMMIBSA-N |
| Mol Weight | 1151.3 g/mol |
| Molecular Formula | C55H90O25 |
| Exact Mass | 1150.577118 g/mol |
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| SpectraBase Spectrum ID | HZ8yzSuMkgA |
|---|---|
| Name | NIGRUMNIN-I;TIGOGENIN-3-O-BETA-D-XYLOPYRANOSYL-(1->3)-[ALPHA-L-ARABINOPYRANOSYL-(1->2)]-BETA-D-GLUCOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL-(1->2 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C55H90O25 |
| InChI | InChI=1S/C55H90O25/c1-21-8-13-55(71-18-21)22(2)34-31(80-55)15-28-26-7-6-24-14-25(9-11-53(24,4)27(26)10-12-54(28,34)5)73-51-46(78-50-42(67)39(64)35(60)23(3)72-50)43(68)44(33(17-57)75-51)76-52-47(79-49-41(66)37(62)30(59)20-70-49)45(38(63)32(16-56)74-52)77-48-40(65)36(61)29(58)19-69-48/h21-52,56-68H,6-20H2,1-5H3/t21-,22+,23+,24+,25+,26-,27+,28+,29-,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42-,43+,44+,45+,46-,47-,48+,49+,50+,51-,52+,53+,54+,55-/m1/s1 |
| InChIKey | YYCFEJVBMMGRLX-HZSDMMIBSA-N |
| Literature Reference Author | T.IKEDA,H.TSUMAGARI,T.NOHARA |
| Literature Reference Citation | CHEM.PHARM.BULL.,48,1062(2000) |
| Literature Reference DOI | 10.1248/cpb.48.1062 |
| Molecular Weight | 1151.305 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN4395 |