![DIANVERSICOSIDE_C;23-O-BETA-D-GLUCOPYRANOSYL-3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-BETA-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLU](/api/spectrum/BJfXwkzABVG/structure.png?h=300&w=458 "DIANVERSICOSIDE_C;23-O-BETA-D-GLUCOPYRANOSYL-3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-BETA-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLU")
| SpectraBase Compound ID | 2q6cYkan9AE |
|---|---|
| InChI | InChI=1S/C66H104O34/c1-60(2)14-16-66(17-15-63(5)26(27(66)18-60)8-9-33-62(4)12-11-35(70)65(7,34(62)10-13-64(33,63)6)58(87)99-55-49(85)45(81)40(76)30(23-69)94-55)59(88)100-56-50(86)51(97-53-47(83)43(79)38(74)28(21-67)92-53)42(78)32(95-56)25-91-57-52(98-54-48(84)44(80)39(75)29(22-68)93-54)46(82)41(77)31(96-57)24-90-37(73)20-61(3,89)19-36(71)72/h8,27-35,38-57,67-70,74-86,89H,9-25H2,1-7H3,(H,71,72)/t27-,28-,29+,30+,31+,32+,33+,34+,35-,38-,39+,40+,41+,42+,43+,44-,45-,46-,47-,48+,49+,50+,51-,52+,53+,54-,55-,56-,57+,61+,62+,63+,64+,65-,66-/m0/s1 |
| InChIKey | AIBXBOWACXMYQP-CSBQHLBSSA-N |
| Mol Weight | 1441.5 g/mol |
| Molecular Formula | C66H104O34 |
| Exact Mass | 1440.6409 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BJfXwkzABVG |
|---|---|
| Name | DIANVERSICOSIDE_C;23-O-BETA-D-GLUCOPYRANOSYL-3-BETA-HYDROXYOLEAN-12-EN-23-ALPHA,28-BETA-DIOIC_ACID_28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)]-[[BETA-D-GLU |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C66H104O34 |
| InChI | InChI=1S/C66H104O34/c1-60(2)14-16-66(17-15-63(5)26(27(66)18-60)8-9-33-62(4)12-11-35(70)65(7,34(62)10-13-64(33,63)6)58(87)99-55-49(85)45(81)40(76)30(23-69)94-55)59(88)100-56-50(86)51(97-53-47(83)43(79)38(74)28(21-67)92-53)42(78)32(95-56)25-91-57-52(98-54-48(84)44(80)39(75)29(22-68)93-54)46(82)41(77)31(96-57)24-90-37(73)20-61(3,89)19-36(71)72/h8,27-35,38-57,67-70,74-86,89H,9-25H2,1-7H3,(H,71,72)/t27-,28-,29+,30+,31+,32+,33+,34+,35-,38-,39+,40+,41+,42+,43+,44-,45-,46-,47-,48+,49+,50+,51-,52+,53+,54-,55-,56-,57+,61+,62+,63+,64+,65-,66-/m0/s1 |
| InChIKey | AIBXBOWACXMYQP-CSBQHLBSSA-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 | 1441.531 g/mol |
| Sample ID | 32374 |
| Solvent | C5D5N |