![GUAIANIN-J;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL](/api/spectrum/6D5rHgPGYF9/structure.png?h=300&w=458 "GUAIANIN-J;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL")
| SpectraBase Compound ID | JVcN5DM5MHT |
|---|---|
| InChI | InChI=1S/C65H104O31/c1-24-34(68)38(72)43(77)55(87-24)95-51-40(74)35(69)25(2)88-58(51)92-48-29(21-66)89-53(45(79)41(48)75)86-23-30-37(71)39(73)44(78)56(90-30)96-59(84)65-18-16-60(3,4)20-27(65)26-10-11-32-62(7)14-13-33(61(5,6)31(62)12-15-64(32,9)63(26,8)17-19-65)91-57-47(81)49(46(80)50(94-57)52(82)83)93-54-42(76)36(70)28(67)22-85-54/h10,24-25,27-51,53-58,66-81H,11-23H2,1-9H3,(H,82,83)/t24-,25-,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+,53-,54-,55+,56+,57-,58+,62+,63-,64-,65+/m1/s1 |
| InChIKey | GKSZZFABCCRDOF-VHVNEZBKSA-N |
| Mol Weight | 1381.5 g/mol |
| Molecular Formula | C65H104O31 |
| Exact Mass | 1380.656157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6D5rHgPGYF9 |
|---|---|
| Name | GUAIANIN-J;3-O-[ALPHA-L-ARABINOPYRANOSYL-(1->3)-BETA-D-GLUCURONOPYRANOSYL]-OLEANOLIC-ACID-28-O-[ALPHA-L-RHAMNOPYRANOSYL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C65H104O31 |
| InChI | InChI=1S/C65H104O31/c1-24-34(68)38(72)43(77)55(87-24)95-51-40(74)35(69)25(2)88-58(51)92-48-29(21-66)89-53(45(79)41(48)75)86-23-30-37(71)39(73)44(78)56(90-30)96-59(84)65-18-16-60(3,4)20-27(65)26-10-11-32-62(7)14-13-33(61(5,6)31(62)12-15-64(32,9)63(26,8)17-19-65)91-57-47(81)49(46(80)50(94-57)52(82)83)93-54-42(76)36(70)28(67)22-85-54/h10,24-25,27-51,53-58,66-81H,11-23H2,1-9H3,(H,82,83)/t24-,25-,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+,53-,54-,55+,56+,57-,58+,62+,63-,64-,65+/m1/s1 |
| InChIKey | GKSZZFABCCRDOF-VHVNEZBKSA-N |
| Literature Reference Author | V.U.AHMAD,S.UDDIN,S.BANO |
| Literature Reference Citation | J.NAT.PROD.,53,1168(1990) |
| Literature Reference DOI | 10.1021/np50071a005 |
| Molecular Weight | 1381.522 g/mol |
| Solvent | CD3OD:D2O |
| Source File Reference | UWRU203 |