herquline B
AlkaPlorer ID: AK011693
Synonym: '', 'Herquline B', '15-methyl-15,17-diazatetracyclo12.2.2.1(3,7).1(8,12)icosa-3(20),12(19)-diene-6,9-dione'
IUPAC Name: (1S,7R,8S,14S)-15-methyl-15,17-diazatetracyclo[12.2.2.13,7.18,12]icosa-3(20),12(19)-diene-6,9-dione
Structure
SMILES: CN1C[C@@H]2CC3=C[C@@H](C(=O)CC3)[C@@H]3C=C(CCC3=O)C[C@H]1CN2
InChI: InChI=1S/C19H26N2O2/c1-21-11-14-6-12-2-4-18(22)16(8-12)17-9-13(3-5-19(17)23)7-15(21)10-20-14/h8-9,14-17,20H,2-7,10-11H2,1H3/t14-,15-,16+,17-/m0/s1
InChIKey: IKEHAWAEPHQJSM-NXOAAHMSSA-N
Reference
Herquline B, a New Platelet Aggregation Inhibitor Produced by Penicillium herquei Fg-372.
PubChem CID: 162846489
LOTUS: LTS0100639
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Penicillium herquei | Penicillium | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 314.42900000000003
TPSA？: 49.41
MolLogP？: 1.8634
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 5
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|