(5S)-5-C-(3-Carboxy-2,3,4,9-tetrahydro-1H-pyrido(3,4-b)indol-1-yl)-D-arabinitol
AlkaPlorer ID: AK006130
Synonym: None
IUPAC Name: 1-[(1S,2R,3S,4R)-1,2,3,4,5-pentahydroxypentyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Structure
SMILES: C1C(NC(C2=C1C3=CC=CC=C3N2)[C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)O)C(=O)O
InChI: InChI=1S/C17H22N2O7/c20-6-11(21)14(22)16(24)15(23)13-12-8(5-10(19-13)17(25)26)7-3-1-2-4-9(7)18-12/h1-4,10-11,13-16,18-24H,5-6H2,(H,25,26)/t10?,11-,13?,14+,15+,16+/m1/s1
InChIKey: LCHFAYIGHOVWSA-LEDUIRAGSA-N
Reference
Trypargine Alkaloids from a Previously Undescribed <i>Eudistoma</i> sp. Ascidian
PubChem CID: 192669
CAS: 154204-09-8
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Eudistoma sp. | Eudistoma | Polycitoridae | Aplousobranchia | Ascidiacea | Chordata | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 366.37000000000006
TPSA？: 166.26999999999998
MolLogP？: -1.7561999999999993
Number of H-Donors: 8
Number of H-Acceptors: 7
RingCount: 3
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|