| SpectraBase Compound ID | DZ63qGthxaK |
|---|---|
| InChI | InChI=1S/C23H28O8/c1-26-17-8-13(9-18(27-2)21(17)24)6-15-12-31-23(25)16(15)7-14-10-19(28-3)22(30-5)20(11-14)29-4/h8-11,15-16,24H,6-7,12H2,1-5H3/t15-,16+/m0/s1 |
| InChIKey | GILRSQFSEAWGIA-JKSUJKDBSA-N |
| Mol Weight | 432.47 g/mol |
| Molecular Formula | C23H28O8 |
| Exact Mass | 432.178418 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LMBhZ3qodaO |
|---|---|
| Name | (+-)-Hernolactone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H28O8 |
| InChI | InChI=1S/C23H28O8/c1-26-17-8-13(9-18(27-2)21(17)24)6-15-12-31-23(25)16(15)7-14-10-19(28-3)22(30-5)20(11-14)29-4/h8-11,15-16,24H,6-7,12H2,1-5H3/t15-,16+/m0/s1 |
| InChIKey | GILRSQFSEAWGIA-JKSUJKDBSA-N |
| Molecular Weight | 432.469 g/mol |
| SMILES | Oc1c(cc(C[C@@]2([C@](C(OC2)=O)(Cc2cc(OC)c(c(c2)OC)OC)[H])[H])cc1OC)OC |
| SPLASH | splash10-001i-0900700000-8efe120b9095879c7097 |
| Source of Spectrum | E1-37-71-1 |
| Synonyms | (3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]-2-oxolanone (3R,4R)-4-[(4-hydroxy-3,5-dimethoxyphenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one (3R,4R)-4-[(4-hydroxy-3,5-dimethoxy-phenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]tetrahydrofuran-2-one (3R,4R)-4-[(3,5-dimethoxy-4-oxidanyl-phenyl)methyl]-3-[(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one |
| Wiley ID | 1517508 |