SpectraBase Spectrum ID |
Khq63mFd1ZK |
Name |
(3S,4S)-6-Acetyl-3,4,7-trihydroxy-2,2-dimethylchroman |
Alternate Name(s) |
1-[(3S,4S)-3,4,7-trihydroxy-2,2-dimethyl-3,4-dihydro-2H-chromen-6-yl]ethanone |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H16O5 |
InChI |
InChI=1S/C13H16O5/c1-6(14)7-4-8-10(5-9(7)15)18-13(2,3)12(17)11(8)16/h4-5,11-12,15-17H,1-3H3/t11-,12-/m0/s1 |
InChIKey |
VUPPIEZLVWZMRF-RYUDHWBXSA-N |
Molecular Weight |
252.266 g/mol |
SMILES |
O[C@@]1([C@@](C(Oc2c1cc(c(c2)O)C(=O)C)(C)C)(O)[H])[H] |
SPLASH |
splash10-000x-9400000000-67b403d896095ac13d8f |
Source of Spectrum |
KD-15-33-2 |
Wiley ID |
1636624 |