| SpectraBase Compound ID | 2FWPifMQsPv |
|---|---|
| InChI | InChI=1S/C46H74O18/c1-10-21(2)40(53)63-38-24(5)60-42(36(52)39(38)57-9)64-37-23(4)58-31(17-29(37)56-8)61-25-11-14-44(7)27-12-15-43(6)26(13-16-45(43,54)32(27)28(19-47)46(44,55)18-25)22(3)59-41-35(51)34(50)33(49)30(20-48)62-41/h10,19,22-39,41-42,48-52,54-55H,11-18,20H2,1-9H3/b21-10+/t22-,23+,24-,25-,26+,27-,28-,29+,30-,31-,32-,33-,34+,35-,36-,37+,38-,39-,41-,42+,43+,44+,45-,46-/m0/s1 |
| InChIKey | DKFHSGBKZJIVMD-VEFRUIPISA-N |
| Mol Weight | 915.1 g/mol |
| Molecular Formula | C46H74O18 |
| Exact Mass | 914.487516 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2zCrEXxIpd |
|---|---|
| Name | #8;HOODISTANALOSIDE-A;5-ALPHA,14-BETA-DIHYDROXY-5-(6->7)-ABEO-PREGNAN-7-ALPHA-AL-20-O-BETA-D-GLUCOPYRANOSYL-3-O-BETA-(4-O-TIGLOYL)-D-THEVETOPYRANOSYL-(1->4)-BE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H74O18 |
| InChI | InChI=1S/C46H74O18/c1-10-21(2)40(53)63-38-24(5)60-42(36(52)39(38)57-9)64-37-23(4)58-31(17-29(37)56-8)61-25-11-14-44(7)27-12-15-43(6)26(13-16-45(43,54)32(27)28(19-47)46(44,55)18-25)22(3)59-41-35(51)34(50)33(49)30(20-48)62-41/h10,19,22-39,41-42,48-52,54-55H,11-18,20H2,1-9H3/b21-10+/t22-,23+,24-,25-,26+,27-,28-,29+,30-,31-,32-,33-,34+,35-,36-,37+,38-,39-,41-,42+,43+,44+,45-,46-/m0/s1 |
| InChIKey | DKFHSGBKZJIVMD-VEFRUIPISA-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 | 915.083 g/mol |
| Sample ID | 64652 |
| Solvent | C5D5N |