| SpectraBase Compound ID | Iz8BUF4TpMt |
|---|---|
| InChI | InChI=1S/C30H38O6/c1-16-17-8-9-20-27(3,18(17)12-19(31)24(16)34)10-11-29(5)21-13-28(4,25(35)36-7)22(32)14-26(21,2)15-23(33)30(20,29)6/h8-9,12,21,23,33-34H,10-11,13-15H2,1-7H3/t21?,23-,26+,27-,28-,29-,30-/m0/s1 |
| InChIKey | FATJTRUVRFSESL-QYGXNXCUSA-N |
| Mol Weight | 494.6 g/mol |
| Molecular Formula | C30H38O6 |
| Exact Mass | 494.266839 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 82HOdCteULQ |
|---|---|
| Name | 15-ALPHA-HYDROXY-21-KETO-PRISTIMERINE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H38O6 |
| InChI | InChI=1S/C30H38O6/c1-16-17-8-9-20-27(3,18(17)12-19(31)24(16)34)10-11-29(5)21-13-28(4,25(35)36-7)22(32)14-26(21,2)15-23(33)30(20,29)6/h8-9,12,21,23,33-34H,10-11,13-15H2,1-7H3/t21?,23-,26+,27-,28-,29-,30-/m0/s1 |
| InChIKey | FATJTRUVRFSESL-QYGXNXCUSA-N |
| Literature Reference Author | N.L.ALVARENGA,C.A.VELAZQUEZ,R.GOMEZ,N.J.CANELA,I.L.BAZZOCCHI ,E.A.FERRO |
| Literature Reference Citation | J.NAT.PROD.,62,750(1999) |
| Literature Reference DOI | 10.1021/np980359p |
| Molecular Weight | 494.628 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWCP7614 |