83481-23-6
AlkaPlorer ID: AK106436
Synonym: '', 'Chaetoglobosin L'
IUPAC Name: (1R,3E,6R,7E,9S,11E,13R,14S,16S,17R,18S)-16-ethyl-6,14-dihydroxy-18-[(1R)-1-(1H-indol-3-yl)ethyl]-7,9-dimethyl-15-methylidene-19-azatricyclo[11.7.0.01,17]icosa-3,7,11-triene-2,5,20-trione
Structure
SMILES: C=C1[C@@H](O)[C@@H]2/C=C/C[C@H](C)/C=C(\C)[C@@H](O)C(=O)/C=C/C(=O)[C@]23C(=O)N[C@@H]([C@H](C)C2=CNC4=CC=CC=C24)[C@@H]3[C@@H]1CC
InChI: InChI=1S/C34H40N2O5/c1-6-22-21(5)32(40)25-12-9-10-18(2)16-19(3)31(39)27(37)14-15-28(38)34(25)29(22)30(36-33(34)41)20(4)24-17-35-26-13-8-7-11-23(24)26/h7-9,11-18,20,22,25,29-32,35,39-40H,5-6,10H2,1-4H3,(H,36,41)/b12-9+,15-14+,19-16+/t18-,20+,22+,25-,29-,30-,31+,32+,34+/m0/s1
InChIKey: PTACSLBMGBVOKZ-FIPYNMRVSA-N
Reference
Chaetoglobosin L, a New Metabolite of Diplodia macrospora
PubChem CID: 14208874
LOTUS: LTS0275956
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Stenocarpella macrospora | Stenocarpella | Diaporthaceae | Diaporthales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 556.7030000000001
TPSA？: 119.48999999999998
MolLogP？: 4.543100000000004
Number of H-Donors: 4
Number of H-Acceptors: 5
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|