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CHEBI:225732 - Ascherxanthone A
| Formula | C32H34O10 |
| Net Charge | 0 |
| Average Mass | 578.614 |
| Monoisotopic Mass | 578.21520 |
| SMILES | CO[C@@H]1CC=C2C(=O)c3c(cc(C)c(-c4c(C)cc5c(c4O)C(=O)C4=CC[C@@H](OC)[C@H](O)[C@@]4(C)O5)c3O)O[C@]2(C)[C@H]1O |
| InChI | InChI=1S/C32H34O10/c1-13-11-19-23(25(33)15-7-9-17(39-5)29(37)31(15,3)41-19)27(35)21(13)22-14(2)12-20-24(28(22)36)26(34)16-8-10-18(40-6)30(38)32(16,4)42-20/h7-8,11-12,17-18,29-30,35-38H,9-10H2,1-6H3/t17-,18-,29+,30+,31+,32+/m1/s1 |
| InChIKey | RLBXNYCARFXYIU-QGLVJRRPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aschersonia (ncbitaxon:100986) | - | PubMed (15974626) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Ascherxanthone A (CHEBI:225732) is a xanthones (CHEBI:51149) |
| IUPAC Name |
|---|
| (3R,4S,4aS)-7-[(5S,6R,10aS)-1,5-dihydroxy-6-methoxy-3,10a-dimethyl-9-oxo-6,7-dihydro-5H-xanthen-2-yl]-4,8-dihydroxy-3-methoxy-4a,6-dimethyl-3,4-dihydro-2H-xanthen-9-one |
| Manual Xrefs | Databases |
|---|---|
| 78438321 | ChemSpider |