| SpectraBase Compound ID | H2JeAvoaKbk |
|---|---|
| InChI | InChI=1S/C46H72O17/c1-10-21(2)41(53)62-39-24(5)59-43(37(52)40(39)56-9)63-38-23(4)57-32(18-30(38)55-8)60-25-11-14-44(6)28-12-15-45(7)27(13-16-46(45,54)33(28)26(19-47)29(44)17-25)22(3)58-42-36(51)35(50)34(49)31(20-48)61-42/h10,19,22-25,27-28,30-40,42-43,48-52,54H,11-18,20H2,1-9H3/b21-10+/t22-,23+,24-,25-,27+,28-,30+,31-,32-,33+,34-,35+,36-,37-,38+,39-,40-,42-,43+,44+,45+,46-/m0/s1 |
| InChIKey | FDUAQIONTUDZAQ-UXVPXOHFSA-N |
| Mol Weight | 897.1 g/mol |
| Molecular Formula | C46H72O17 |
| Exact Mass | 896.476951 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ECP5jkuuNbP |
|---|---|
| Name | #9;HOODISTANALOSIDE-B;14-BETA-DIHYDROXY-5-(6->7)-ABEO-PREGN-5-EN-7-AL-20-O-BETA-D-GLUCOPYRANOSYL-3-O-BETA-(4-O-TIGLOYL)-D-THEVETOPYRANOSYL-(1->4)-BETA-D-OLEAND |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H72O17 |
| InChI | InChI=1S/C46H72O17/c1-10-21(2)41(53)62-39-24(5)59-43(37(52)40(39)56-9)63-38-23(4)57-32(18-30(38)55-8)60-25-11-14-44(6)28-12-15-45(7)27(13-16-46(45,54)33(28)26(19-47)29(44)17-25)22(3)58-42-36(51)35(50)34(49)31(20-48)61-42/h10,19,22-25,27-28,30-40,42-43,48-52,54H,11-18,20H2,1-9H3/b21-10+/t22-,23+,24-,25-,27+,28-,30+,31-,32-,33+,34-,35+,36-,37-,38+,39-,40-,42-,43+,44+,45+,46-/m0/s1 |
| InChIKey | FDUAQIONTUDZAQ-UXVPXOHFSA-N |
| Literature Reference Author | Y.J.SHUKLA,R.S.PAWAR,Y.DING,X.C.LI,D.FERREIRA,I.A.KHAN |
| Literature Reference Citation | PHYTOCHEM.,70,675(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.02.006 |
| Molecular Weight | 897.067 g/mol |
| Sample ID | 64653 |
| Solvent | C5D5N |