![NEOCHLOROGENIN-6-O-[ALPHA-RHAMNOPYRANOSYL-(1->3)-BETA-D-QUINOVOPYRANOSIDE];(25S)-5-ALPHA-SPIROSTAN-3-BETA-OL-6-O-ALPHA-[ALPHA-RHAMNOPYRANOSYL-(1->](/api/spectrum/3N5bKMc4COO/structure.png?h=300&w=458 "NEOCHLOROGENIN-6-O-[ALPHA-RHAMNOPYRANOSYL-(1->3)-BETA-D-QUINOVOPYRANOSIDE];(25S)-5-ALPHA-SPIROSTAN-3-BETA-OL-6-O-ALPHA-[ALPHA-RHAMNOPYRANOSYL-(1->")
| SpectraBase Compound ID | HljXtuIuYLn |
|---|---|
| InChI | InChI=1S/C39H64O12/c1-17-7-12-39(46-16-17)18(2)28-27(51-39)15-24-22-14-26(25-13-21(40)8-10-37(25,5)23(22)9-11-38(24,28)6)49-36-33(45)34(30(42)20(4)48-36)50-35-32(44)31(43)29(41)19(3)47-35/h17-36,40-45H,7-16H2,1-6H3/t17-,18+,19-,20+,21+,22?,23?,24?,25-,26+,27?,28?,29-,30+,31+,32+,33+,34-,35-,36-,37-,38+,39-/m1/s1 |
| InChIKey | XASDQEOMZDFLDT-WDOQCVIGSA-N |
| Mol Weight | 724.9 g/mol |
| Molecular Formula | C39H64O12 |
| Exact Mass | 724.439777 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 | 3N5bKMc4COO |
|---|---|
| Name | NEOCHLOROGENIN-6-O-[ALPHA-RHAMNOPYRANOSYL-(1->3)-BETA-D-QUINOVOPYRANOSIDE];(25S)-5-ALPHA-SPIROSTAN-3-BETA-OL-6-O-ALPHA-[ALPHA-RHAMNOPYRANOSYL-(1-> |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H64O12 |
| InChI | InChI=1S/C39H64O12/c1-17-7-12-39(46-16-17)18(2)28-27(51-39)15-24-22-14-26(25-13-21(40)8-10-37(25,5)23(22)9-11-38(24,28)6)49-36-33(45)34(30(42)20(4)48-36)50-35-32(44)31(43)29(41)19(3)47-35/h17-36,40-45H,7-16H2,1-6H3/t17-,18+,19-,20+,21+,22?,23?,24?,25-,26+,27?,28?,29-,30+,31+,32+,33+,34-,35-,36-,37-,38+,39-/m1/s1 |
| InChIKey | XASDQEOMZDFLDT-WDOQCVIGSA-N |
| Literature Reference Author | S.YAHARA,T.YAMASHITA,N.NOZAWA,T.NOHARA |
| Literature Reference Citation | PHYTOCHEM.,43,1069(1996) |
| Literature Reference DOI | 10.1016/S0031-9422(96)00396-2 |
| Molecular Weight | 724.930 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS2302 |