![#1;MAETENOSIDE-A;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURO](/api/spectrum/HjwP4Xg4mLn/structure.png?h=300&w=458 "#1;MAETENOSIDE-A;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURO")
| SpectraBase Compound ID | LPUrvbowuq4 |
|---|---|
| InChI | InChI=1S/C65H104O30/c1-11-25(2)54(84)89-36-20-60(4,5)18-28-27-12-13-33-62(8)16-15-35(61(6,7)32(62)14-17-63(33,9)64(27,10)19-34(70)65(28,36)24-69)90-59-52(95-56-46(80)42(76)39(73)30(22-67)87-56)48(47(81)49(92-59)53(82)83)91-58-51(44(78)40(74)31(23-68)88-58)94-57-50(43(77)37(71)26(3)85-57)93-55-45(79)41(75)38(72)29(21-66)86-55/h11-12,26,28-52,55-59,66-81H,13-24H2,1-10H3,(H,82,83)/b25-11-/t26-,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+,55+,56+,57-,58-,59+,62+,63-,64-,65+/m1/s1 |
| InChIKey | QGVPVTDQNDRBNJ-ZHUZJHQISA-N |
| Mol Weight | 1365.5 g/mol |
| Molecular Formula | C65H104O30 |
| Exact Mass | 1364.661242 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HjwP4Xg4mLn |
|---|---|
| Name | #1;MAETENOSIDE-A;3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSYL-(1->3)]-[BETA-D-GLUCOPYRANOSYL-(1->2)]-BETA-D-GLUCURO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H104O30 |
| InChI | InChI=1S/C65H104O30/c1-11-25(2)54(84)89-36-20-60(4,5)18-28-27-12-13-33-62(8)16-15-35(61(6,7)32(62)14-17-63(33,9)64(27,10)19-34(70)65(28,36)24-69)90-59-52(95-56-46(80)42(76)39(73)30(22-67)87-56)48(47(81)49(92-59)53(82)83)91-58-51(44(78)40(74)31(23-68)88-58)94-57-50(43(77)37(71)26(3)85-57)93-55-45(79)41(75)38(72)29(21-66)86-55/h11-12,26,28-52,55-59,66-81H,13-24H2,1-10H3,(H,82,83)/b25-11-/t26-,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+,55+,56+,57-,58-,59+,62+,63-,64-,65+/m1/s1 |
| InChIKey | QGVPVTDQNDRBNJ-ZHUZJHQISA-N |
| Literature Reference Author | K.KOIKE,Z.JIA,T.NIKAIDO |
| Literature Reference Citation | CHEM.PHARM.BULL.,49,758(2001) |
| Literature Reference DOI | 10.1248/cpb.49.758 |
| Molecular Weight | 1365.523 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU31733 |