Avellanin A
AlkaPlorer ID: AK289820
Synonym: None
IUPAC Name: 10-benzyl-16-butan-2-yl-9,13-dimethyl-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: CCC(C)C1N=C(O)C(C)N=C(O)C(CC2=CC=CC=C2)N(C)C(=O)C2CCCN2C(=O)C2=CC=CC=C2N=C1O
InChI: InChI=1S/C31H39N5O5/c1-5-19(2)26-29(39)33-23-15-10-9-14-22(23)30(40)36-17-11-16-24(36)31(41)35(4)25(18-21-12-7-6-8-13-21)28(38)32-20(3)27(37)34-26/h6-10,12-15,19-20,24-26H,5,11,16-18H2,1-4H3,(H,32,38)(H,33,39)(H,34,37)
InChIKey: YTLVJHJIRIHWGD-UHFFFAOYSA-N
Reference
New fungal metabolites avellanins A and B from Hamigera avellanea, with pressor effect.
PubChem CID: 14258272
LOTUS: LTS0183985
COCONUT: CNP0284098.5
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Hamigera avellanea | Hamigera | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 561.6830000000002
TPSA？: 138.39
MolLogP？: 4.678700000000004
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 4
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|