![3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-HEDERAGENIN](/api/spectrum/5TnRPqJNdPV/structure.png?h=300&w=458 "3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-HEDERAGENIN")
| SpectraBase Compound ID | C9EOiJJQOit |
|---|---|
| InChI | InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)54-33-31(47)29(45)24(19-51-33)53-34-32(48)30(46)28(44)23(18-42)52-34/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23-,24+,25-,26-,27+,28-,29+,30+,31-,32-,33+,34+,37+,38+,39-,40-,41+/m1/s1 |
| InChIKey | KAYMPWXMHIUNGC-RWBDFLBLSA-N |
| Mol Weight | 767.0 g/mol |
| Molecular Formula | C41H66O13 |
| Exact Mass | 766.450342 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5TnRPqJNdPV |
|---|---|
| Name | 3-O-[BETA-D-GLUCOPYRANOSYL-(1->4)-ALPHA-L-ARABINOPYRANOSYL]-HEDERAGENIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C41H66O13 |
| InChI | InChI=1S/C41H66O13/c1-36(2)13-15-41(35(49)50)16-14-39(5)21(22(41)17-36)7-8-26-37(3)11-10-27(38(4,20-43)25(37)9-12-40(26,39)6)54-33-31(47)29(45)24(19-51-33)53-34-32(48)30(46)28(44)23(18-42)52-34/h7,22-34,42-48H,8-20H2,1-6H3,(H,49,50)/t22-,23-,24+,25-,26-,27+,28-,29+,30+,31-,32-,33+,34+,37+,38+,39-,40-,41+/m1/s1 |
| InChIKey | KAYMPWXMHIUNGC-RWBDFLBLSA-N |
| Literature Reference Author | S.KITANAKA,I.YASUDA,Y.KASHIWADA,C.Q.HU,K.F.BASTOW,I.D.BORI,K .H.LEE |
| Literature Reference Citation | J.NAT.PROD.,58,1647(1995) |
| Literature Reference DOI | 10.1021/np50125a001 |
| Molecular Weight | 766.967 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWCS22902 |