Homocitrullylaminoadenosine
AlkaPlorer ID: AK300582
Synonym: 3'-Homocitrullylamino-3'-deoxyadenosine
IUPAC Name: 2-amino-N-[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]-6-(carbamoylamino)hexanamide
Structure
SMILES: N=C(O)NCCCCC(N)C(O)=NC1C(CO)OC(N2C=NC3=C(N)N=CN=C32)C1O
InChI: InChI=1S/C17H27N9O5/c18-8(3-1-2-4-21-17(20)30)15(29)25-10-9(5-27)31-16(12(10)28)26-7-24-11-13(19)22-6-23-14(11)26/h6-10,12,16,27-28H,1-5,18H2,(H,25,29)(H2,19,22,23)(H3,20,21,30)
InChIKey: PRSGILKSOMZEFX-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Cordyceps militaris | Cordyceps | Cordycipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 437.4610000000002
TPSA？: 234.03
MolLogP？: -1.435829999999997
Number of H-Donors: 8
Number of H-Acceptors: 11
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|