(2R)-2-[(2S,3S,6R)-3-[(2S)-2-amino-3-hydroxypropanamido]-6-[4-amino-5-(hydroxymethyl)-2-oxopyrimidin-1-yl]-3,6-dihydro-2H-pyran-2-yl]-5-carbamimidamido-2-hydroxypentanoic acid
AlkaPlorer ID: AK051745
Synonym: None
IUPAC Name: (2R)-2-[(2S,3S,6R)-6-[4-amino-5-(hydroxymethyl)-2-oxopyrimidin-1-yl]-3-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3,6-dihydro-2H-pyran-2-yl]-5-(diaminomethylideneamino)-2-hydroxypentanoic acid
Structure
SMILES: N=C(N)NCCC[C@](O)(C(=O)O)[C@H]1O[C@@H](N2C=C(CO)C(=N)N=C2O)C=C[C@@H]1N=C(O)[C@@H](N)CO
InChI: InChI=1S/C19H30N8O8/c20-10(8-29)15(30)25-11-2-3-12(27-6-9(7-28)14(21)26-18(27)33)35-13(11)19(34,16(31)32)4-1-5-24-17(22)23/h2-3,6,10-13,28-29,34H,1,4-5,7-8,20H2,(H,25,30)(H,31,32)(H2,21,26,33)(H4,22,23,24)/t10-,11-,12+,13-,19+/m0/s1
InChIKey: GVLLATLXQPLOAJ-LGSFDMRSSA-N
Reference
PubChem CID: 3070418
CAS: 86432-24-8
LOTUS: LTS0029370
SuperNatural Ⅲ: SN0116394-04
NPASS: NPC228268
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Isodon amethystoides | Isodon | Lamiaceae | Lamiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
| Stachybotrys kampalensis | Stachybotrys | Stachybotryaceae | Hypocreales | Sordariomycetes | Ascomycota | Fungi | Eukaryota |
Properties Information
Molecule Weight: 498.4970000000002
TPSA？: 289.63
MolLogP？: -3.262259999999993
Number of H-Donors: 11
Number of H-Acceptors: 12
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|