| SpectraBase Spectrum ID |
IneE46SAi11 |
| Name |
(3S)-3,4-dihydro-3-[(1S,2R)-1,2-dihydroxy-3-[(4-chlorobenzyl)oxy]propyl]-7-methoxy-1H-2-benzopyran |
| Alternate Name(s) |
(1S,2R)-3-[(4-chlorobenzyl)oxy]-1-(7-methoxy-3,4-dihydro-2H-chromen-3-yl)-1,2-propanediol |
| CAS Registry Number |
114817-49-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H23ClO5 |
| InChI |
InChI=1S/C20H23ClO5/c1-24-17-7-4-14-8-15(11-26-19(14)9-17)20(23)18(22)12-25-10-13-2-5-16(21)6-3-13/h2-7,9,15,18,20,22-23H,8,10-12H2,1H3/t15?,18-,20+/m1/s1 |
| InChIKey |
MNYFUEFEIJMMDR-JFSACEIJSA-N |
| Molecular Weight |
378.852 g/mol |
| SMILES |
O[C@@]([C@](C1Cc2c(cc(cc2)OC)OC1)(O)[H])(COCc1ccc(cc1)Cl)[H] |
| SPLASH |
splash10-004r-0900000000-3b23d96302ae24b4156f |
| Source of Spectrum |
J-53-3291-14 |
| Wiley ID |
1358701 |
![(3S)-3,4-dihydro-3-[(1S,2R)-1,2-dihydroxy-3-[(4-chlorobenzyl)oxy]propyl]-7-methoxy-1H-2-benzopyran](/api/spectrum/IneE46SAi11/structure.png?h=300&w=458 "(3S)-3,4-dihydro-3-[(1S,2R)-1,2-dihydroxy-3-[(4-chlorobenzyl)oxy]propyl]-7-methoxy-1H-2-benzopyran")
