| SpectraBase Compound ID | HPVaLDfusA2 |
|---|---|
| InChI | InChI=1S/C31H48O4/c1-26(2)21-11-14-31(7)22(29(21,5)13-12-23(26)32)10-9-19-20-17-27(3,25(34)35-8)18-24(33)28(20,4)15-16-30(19,31)6/h9,20-23,32H,10-18H2,1-8H3/t20-,21-,22+,23-,27-,28+,29-,30+,31+/m0/s1 |
| InChIKey | ZQRCJNYWUHXNSD-XOOZTFSRSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C31H48O4 |
| Exact Mass | 484.35526 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GwJAk54OrSS |
|---|---|
| Name | SUBPROGENIN-D;METHYL-3-BETA-HYDROXY-OLEAN-12-EN-22-ONE-29-OATE |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O4 |
| InChI | InChI=1S/C31H48O4/c1-26(2)21-11-14-31(7)22(29(21,5)13-12-23(26)32)10-9-19-20-17-27(3,25(34)35-8)18-24(33)28(20,4)15-16-30(19,31)6/h9,20-23,32H,10-18H2,1-8H3/t20-,21-,22+,23-,27-,28+,29-,30+,31+/m0/s1 |
| InChIKey | ZQRCJNYWUHXNSD-XOOZTFSRSA-N |
| Literature Reference Author | S.B.MAHATO,A.P.KUNDU |
| Literature Reference Citation | PHYTOCHEM.,37,1517(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89569-2 |
| Molecular Weight | 484.720 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS5120 |