| SpectraBase Spectrum ID |
5SPVDaGW3XD |
| Name |
9-cis-Ethyl-7,8,9,10-tetrahydro-6,7-rel,9-trans,11-tetrahydroxy-5,12-naphthacenequinone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.110338294 u |
| Formula |
C20H18O6 |
| InChI |
InChI=1S/C20H18O6/c1-2-20(26)7-11-13(12(21)8-20)19(25)15-14(18(11)24)16(22)9-5-3-4-6-10(9)17(15)23/h3-6,12,21,24-26H,2,7-8H2,1H3/t12-,20+/m1/s1 |
| InChIKey |
LLNJQZPRRRZFMP-ODXCJYRJSA-N |
| Molecular Weight |
354.358 g/mol |
| SMILES |
C1=2C=CC=CC2C(=O)C=2C(O)=C3[C@](O)(C[C@](CC3=C(O)C2C1=O)(O)CC)[H] |
