Asporyzin B
AlkaPlorer ID: AK134739
Synonym: None
IUPAC Name: (1S,2S,5S,7R,9S,10R,13S)-15-hydroxy-2,9-dimethyl-7-(2-methylprop-1-enyl)-6-oxa-22-azahexacyclo[11.10.0.02,10.05,9.015,22.016,21]tricosa-16,18,20-trien-23-one
Structure
SMILES: CC(C)=C[C@H]1C[C@@]2(C)[C@@H]3CC[C@H]4CC5(O)C6=CC=CC=C6N5C(=O)[C@@H]4[C@@]3(C)CC[C@@H]2O1
InChI: InChI=1S/C27H35NO3/c1-16(2)13-18-15-26(4)21-10-9-17-14-27(30)19-7-5-6-8-20(19)28(27)24(29)23(17)25(21,3)12-11-22(26)31-18/h5-8,13,17-18,21-23,30H,9-12,14-15H2,1-4H3/t17-,18-,21+,22-,23+,25-,26-,27?/m0/s1
InChIKey: QJYILEDZEZVBBD-IPYQKNEASA-N
Reference
Indoloditerpenes from an algicolous isolate of Aspergillus oryzae
PubChem CID: 52943971
LOTUS: LTS0196382
NPASS: NPC469915
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus oryzae | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 421.5810000000002
TPSA？: 49.77
MolLogP？: 5.154500000000005
Number of H-Donors: 1
Number of H-Acceptors: 3
RingCount: 6
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Artemia salina | Artemia salina | Activity | 42.9 | % | 10.1016/j.bmcl.2010.08.024 |
| Colletotrichum lagenaria | Colletotrichum lagenaria | Activity | nan | None | 10.1016/j.bmcl.2010.08.024 |
| Escherichia coli | Escherichia coli | DIZ | nan | None | 10.1016/j.bmcl.2010.08.024 |
| Fusarium oxysporum | Fusarium oxysporum | Activity | nan | None | 10.1016/j.bmcl.2010.08.024 |
| Homo sapiens | Acetylcholinesterase | Inhibition | 4.0 | % | 10.1016/j.bmcl.2010.08.024 |