Verticilide A1; N-De-Me
AlkaPlorer ID: AK317579
Synonym: Verticilide A2
IUPAC Name: 3,4,9,10,15,16,21-heptamethyl-6,12,18,24-tetrapentyl-1,7,13,19-tetraoxa-4,10,16,22-tetrazacyclotetracosane-2,5,8,11,14,17,20,23-octone
Structure
SMILES: CCCCCC1OC(=O)C(C)N(C)C(=O)C(CCCCC)OC(=O)C(C)N(C)C(=O)C(CCCCC)OC(=O)C(C)N(C)C(=O)C(CCCCC)OC(=O)C(C)NC1=O
InChI: InChI=1S/C43H74N4O12/c1-12-16-20-24-32-36(48)44-28(5)40(52)57-33(25-21-17-13-2)37(49)46(10)30(7)42(54)59-35(27-23-19-15-4)39(51)47(11)31(8)43(55)58-34(26-22-18-14-3)38(50)45(9)29(6)41(53)56-32/h28-35H,12-27H2,1-11H3,(H,44,48)
InChIKey: NCNWFFJOZKHMDH-UHFFFAOYSA-N
Reference
CAS: 1380602-01-6
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Verticillium sp. | Verticillium | Plectosphaerellaceae | Glomerellales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 839.081
TPSA？: 195.23
MolLogP？: 5.013800000000007
Number of H-Donors: 1
Number of H-Acceptors: 12
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|