Avellanin B
AlkaPlorer ID: AK289821
Synonym: None
IUPAC Name: 10-benzyl-9,13-dimethyl-16-propan-2-yl-3,9,12,15,18-pentazatricyclo[17.4.0.03,7]tricosa-1(23),19,21-triene-2,8,11,14,17-pentone
Structure
SMILES: CC1N=C(O)C(CC2=CC=CC=C2)N(C)C(=O)C2CCCN2C(=O)C2=CC=CC=C2N=C(O)C(C(C)C)N=C1O
InChI: InChI=1S/C30H37N5O5/c1-18(2)25-28(38)32-22-14-9-8-13-21(22)29(39)35-16-10-15-23(35)30(40)34(4)24(17-20-11-6-5-7-12-20)27(37)31-19(3)26(36)33-25/h5-9,11-14,18-19,23-25H,10,15-17H2,1-4H3,(H,31,37)(H,32,38)(H,33,36)
InChIKey: DEXQLMIHCYVILW-UHFFFAOYSA-N
Reference
New fungal metabolites avellanins A and B from Hamigera avellanea, with pressor effect.
PubChem CID: 14258275
LOTUS: LTS0179868
COCONUT: CNP0245079.3
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hamigera avellanea | Hamigera | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 547.6560000000003
TPSA？: 138.39
MolLogP？: 4.288600000000002
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|