campesine E
AlkaPlorer ID: AK000228
Synonym: None
IUPAC Name: 1-[(9R,12S,15S,25R,28S)-12,28-di(propan-2-yl)-8,10,13,24,26-pentaza-29-azoniaoctacyclo[15.15.0.01,9.02,7.010,15.017,25.018,23.026,31]dotriaconta-2,4,6,18,20,22-hexaen-13-yl]ethanone
Structure
SMILES: CC(C)[C@H]1CN2[C@@H]3C4(C[C@H]5CN([C@H](CN5[C@@H]6C4(CC2C[NH2+]1)C7=CC=CC=C7N6)C(C)C)C(=O)C)C8=CC=CC=C8N3
InChI: InChI=1S/C34H46N6O/c1-20(2)29-18-39-23(16-35-29)14-33-25-10-6-8-12-27(25)37-32(33)40-19-30(21(3)4)38(22(5)41)17-24(40)15-34(33)26-11-7-9-13-28(26)36-31(34)39/h6-13,20-21,23-24,29-32,35-37H,14-19H2,1-5H3/p+1/t23?,24-,29+,30+,31+,32+,33?,34?/m0/s1
InChIKey: NJNCAOZBUVHJMN-LQLHSHTNSA-O
Reference
PubChem CID: 172429332
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Aspergillus campestris | Aspergillus | Aspergillaceae | Eurotiales | Eurotiomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 555.7910000000003
TPSA？: 67.46
MolLogP？: 3.002500000000004
Number of H-Donors: 3
Number of H-Acceptors: 5
RingCount: 8
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|