| SpectraBase Spectrum ID |
LZWIzNmk9sg |
| Name |
Penta-O-methyldavallialactol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H34O9 |
| InChI |
InChI=1S/C30H34O9/c1-17-13-21(31)27(29(38-17)19-9-12-23(34-3)25(15-19)36-5)28-26(37-6)16-20(39-30(28)32)10-7-18-8-11-22(33-2)24(14-18)35-4/h7-12,14-17,21,27,29,31H,13H2,1-6H3/b10-7+/t17-,21?,27+,29+/m0/s1 |
| InChIKey |
KGKVZZIDWRPHBI-BFMVCNFISA-N |
| Molecular Weight |
538.593 g/mol |
| SMILES |
OC1[C@](C=2C(OC(=CC2OC)\C=C\c2cc(OC)c(cc2)OC)=O)([C@](O[C@](C1)(C)[H])(c1cc(OC)c(cc1)OC)[H])[H] |
| SPLASH |
splash10-0ini-0309020000-3788317481cf20e1c661 |
| Source of Spectrum |
E1-40-1717-4 |
| Synonyms |
Penta-O-methyldavallialactol isomer |
| Wiley ID |
1519624 |
