3-(Aminomethyl)-1,2,7-trihydroxy-5-(hydroxymethyl)-1H-pyrrolizidine; (1S,2R,3R,5S,7R,7aR)-form, N-Ac
AlkaPlorer ID: AK286550
Synonym: Pochonicine
IUPAC Name: N-[[1,2,7-trihydroxy-5-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methyl]acetamide
Structure
SMILES: CC(O)=NCC1C(O)C(O)C2C(O)CC(CO)N12
InChI: InChI=1S/C11H20N2O5/c1-5(15)12-3-7-10(17)11(18)9-8(16)2-6(4-14)13(7)9/h6-11,14,16-18H,2-4H2,1H3,(H,12,15)
InChIKey: MQMFKTWPMVRWJQ-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Pochonia | Clavicipitaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 260.29
TPSA？: 116.75
MolLogP？: -2.1370999999999984
Number of H-Donors: 5
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|