| SpectraBase Spectrum ID |
Dy7C4HQ8jKY |
| Name |
1H-2-Benzopyran-6-acetic acid, 5,7-bis(acetyloxy)octahydro-8a-(hydroxymethyl)-3-methoxy-, methyl ester, (3.alpha.,4a.alpha.,5.alpha.,6.beta.,7.alpha.,8a.alpha.)-(.+-.)- |
| Alternate Name(s) |
5.alpha.,7.alpha.-diacetoxy-8a.alpha.-hydroxymethyl-3.beta.-methoxy-6.beta.-methoxycarbonyl-4a.alpha.-perhydroisochlomane
Methyl[(3R,4aS,5R,6R,7S,8aS)-5,7-bis(acetyloxy)-8a-(hydroxymethyl)-3-methoxyoctahydro-1H-2-benzopyran-6-yl]acetate |
| CAS Registry Number |
74269-85-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H28O9 |
| InChI |
InChI=1S/C18H28O9/c1-10(20)26-14-7-18(8-19)9-25-16(24-4)6-13(18)17(27-11(2)21)12(14)5-15(22)23-3/h12-14,16-17,19H,5-9H2,1-4H3/t12-,13-,14+,16-,17+,18+/m1/s1 |
| InChIKey |
HIIGZGLXBOKGDT-WNIVTNPTSA-N |
| Molecular Weight |
388.413 g/mol |
| SMILES |
OC[C@]12[C@@]([C@@](OC(=O)C)([C@@]([C@](C2)(OC(=O)C)[H])(CC(=O)OC)[H])[H])(C[C@@](OC1)(OC)[H])[H] |
| SPLASH |
splash10-0006-9100000000-ee023ae98f14d78191ee |
| Source of Spectrum |
F-35-2395-0 |
| Wiley ID |
1363657 |
