![DIANVERSICOSIDE_D;3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-6](/api/spectrum/JT8pFTrzr9E/structure.png?h=300&w=458 "DIANVERSICOSIDE_D;3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-6")
| SpectraBase Compound ID | KPIYDSVFU4v |
|---|---|
| InChI | InChI=1S/C60H94O29/c1-54(2)14-16-60(17-15-57(5)25(26(60)18-54)8-9-31-56(4)12-11-33(63)59(7,52(77)78)32(56)10-13-58(31,57)6)53(79)89-50-45(76)46(87-48-43(74)40(71)36(67)27(21-61)83-48)39(70)30(85-50)24-82-51-47(88-49-44(75)41(72)37(68)28(22-62)84-49)42(73)38(69)29(86-51)23-81-35(66)20-55(3,80)19-34(64)65/h8,26-33,36-51,61-63,67-76,80H,9-24H2,1-7H3,(H,64,65)(H,77,78)/t26-,27-,28+,29+,30+,31+,32+,33-,36-,37+,38+,39+,40+,41-,42-,43-,44+,45+,46-,47+,48+,49-,50-,51+,55+,56+,57+,58+,59-,60-/m0/s1 |
| InChIKey | NMZXWJLQTSMVIG-UBRAWXMSSA-N |
| Mol Weight | 1279.4 g/mol |
| Molecular Formula | C60H94O29 |
| Exact Mass | 1278.588077 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JT8pFTrzr9E |
|---|---|
| Name | DIANVERSICOSIDE_D;3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLUCOPYRANOSYL-(1->2)]-[BETA-D-6 |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C60H94O29 |
| InChI | InChI=1S/C60H94O29/c1-54(2)14-16-60(17-15-57(5)25(26(60)18-54)8-9-31-56(4)12-11-33(63)59(7,52(77)78)32(56)10-13-58(31,57)6)53(79)89-50-45(76)46(87-48-43(74)40(71)36(67)27(21-61)83-48)39(70)30(85-50)24-82-51-47(88-49-44(75)41(72)37(68)28(22-62)84-49)42(73)38(69)29(86-51)23-81-35(66)20-55(3,80)19-34(64)65/h8,26-33,36-51,61-63,67-76,80H,9-24H2,1-7H3,(H,64,65)(H,77,78)/t26-,27-,28+,29+,30+,31+,32+,33-,36-,37+,38+,39+,40+,41-,42-,43-,44+,45+,46-,47+,48+,49-,50-,51+,55+,56+,57+,58+,59-,60-/m0/s1 |
| InChIKey | NMZXWJLQTSMVIG-UBRAWXMSSA-N |
| Literature Reference Author | L.MA,Y.C.GU,J.G.LUO,J.S.WANG,X.F.HUANG,L.Y.KONG |
| Literature Reference Citation | J.NAT.PROD.,72,640(2009) |
| Literature Reference DOI | 10.1021/np800589a |
| Molecular Weight | 1279.389 g/mol |
| Sample ID | 32375 |
| Solvent | CD3OD |