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CHEBI:208046 - Pyrrospirone J
| Formula | C30H37NO6 |
| Net Charge | 0 |
| Average Mass | 507.627 |
| Monoisotopic Mass | 507.26209 |
| SMILES | C[C@@H]1C[C@H](C)[C@H]2[C@H]3Oc4ccc(cc4)C[C@@]4(O)C[C@]5(O[C@@]6(C)[C@@H]7O[C@]7(C)[C@H]([C@H]3[C@H]6C5=O)[C@]2(C)C1)C(=O)N4 |
| InChI | InChI=1S/C30H37NO6/c1-14-10-15(2)19-21-18-20-23(32)30(37-27(20,4)24-28(5,36-24)22(18)26(19,3)11-14)13-29(34,31-25(30)33)12-16-6-8-17(35-21)9-7-16/h6-9,14-15,18-22,24,34H,10-13H2,1-5H3,(H,31,33)/t14-,15+,18+,19+,20+,21+,22-,24+,26-,27-,28-,29-,30-/m1/s1 |
| InChIKey | JPDSHMGNMVVJML-LUDGVEMVSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Penicillium (ncbitaxon:5073) | - | PubMed (31096582) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Pyrrospirone J (CHEBI:208046) is a azamacrocycle (CHEBI:52898) |
| Pyrrospirone J (CHEBI:208046) is a keratan 6'-sulfate (CHEBI:18331) |
| IUPAC Name |
|---|
| (3S,4R,5S,7R,9R,10R,11R,13R,14R,15R,17R,20R,29S)-20-hydroxy-5,7,9,11,14-pentamethyl-2,12,28-trioxa-19-azaoctacyclo[20.2.2.13,10.114,17.117,20.04,9.011,13.015,29]nonacosa-1(25),22(26),23-triene-16,18-dione |