| SpectraBase Compound ID | AqjooTlvcGu |
|---|---|
| InChI | InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26+,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+,56+,57+,60+,61+,62-,63-,64+/m1/s1 |
| InChIKey | PLQZZVHULIUSEV-KRVCWHSHSA-N |
| Mol Weight | 1353.5 g/mol |
| Molecular Formula | C64H104O30 |
| Exact Mass | 1352.661242 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | C95eNgfHW1u |
|---|---|
| Name | SIEBOLDIANOSIDE-A;#1;3-O-BETA-D-XYLOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL-HEDERAGENIN-28-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C64H104O30 |
| InChI | InChI=1S/C64H104O30/c1-25-36(69)41(74)45(78)54(86-25)91-49-31(20-65)88-52(47(80)43(49)76)85-23-32-40(73)42(75)46(79)55(89-32)94-58(82)64-17-15-59(3,4)19-28(64)27-9-10-34-60(5)13-12-35(61(6,24-66)33(60)11-14-63(34,8)62(27,7)16-18-64)90-57-51(39(72)30(68)22-84-57)93-56-48(81)50(37(70)26(2)87-56)92-53-44(77)38(71)29(67)21-83-53/h9,25-26,28-57,65-81H,10-24H2,1-8H3/t25-,26+,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+,56+,57+,60+,61+,62-,63-,64+/m1/s1 |
| InChIKey | PLQZZVHULIUSEV-KRVCWHSHSA-N |
| Literature Reference Author | H.SAWADA,M.MIYAKOSHI,S.ISODA,Y.IDA,J.SHOJI |
| Literature Reference Citation | PHYTOCHEM.,34,1117(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90727-1 |
| Molecular Weight | 1353.512 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWVN6927 |