| SpectraBase Compound ID | ID6UjsL1nEP |
|---|---|
| InChI | InChI=1S/C30H50O5/c1-17(2)10-9-12-29(7,35)18-14-23(34)30(8)24(18)19(31)15-21-27(5)13-11-22(33)26(3,4)25(27)20(32)16-28(21,30)6/h10,18,20-25,32-35H,9,11-16H2,1-8H3/t18-,20-,21?,22-,23-,24?,25?,27+,28+,29?,30+/m0/s1 |
| InChIKey | XPKDWTIMEBKOMC-KKOQKHGOSA-N |
| Mol Weight | 490.7 g/mol |
| Molecular Formula | C30H50O5 |
| Exact Mass | 490.365825 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6FaRhgPJzRB |
|---|---|
| Name | 12-OXO-15-ALPHA-HYDROXYL-20-(S)-PROTOPANAXATRIOL |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O5 |
| InChI | InChI=1S/C30H50O5/c1-17(2)10-9-12-29(7,35)18-14-23(34)30(8)24(18)19(31)15-21-27(5)13-11-22(33)26(3,4)25(27)20(32)16-28(21,30)6/h10,18,20-25,32-35H,9,11-16H2,1-8H3/t18-,20-,21?,22-,23-,24?,25?,27+,28+,29?,30+/m0/s1 |
| InChIKey | XPKDWTIMEBKOMC-KKOQKHGOSA-N |
| Literature Reference Author | Y.TIAN,H.GUO,J.HAN,D.GUO |
| Literature Reference Citation | J.NAT.PROD.,68,678(2005) |
| Literature Reference DOI | 10.1021/np049688+ |
| Molecular Weight | 490.724 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ9862 |