UNPD144597
AlkaPlorer ID: AK207355
Synonym: None
IUPAC Name: 4-[cyano-[(2R,3R,5S,6S)-2,3,4,5,6-pentahydroxycyclohexyl]oxymethylidene]hex-2-enedioic acid
Structure
SMILES: N#CC(O[C@@H]1[C@H](O)[C@H](O)[C@H](O)[C@H](O)[C@@H]1O)=C(C=CC(=O)O)CC(=O)O
InChI: InChI=1S/C14H17NO10/c15-4-6(5(3-8(18)19)1-2-7(16)17)25-14-12(23)10(21)9(20)11(22)13(14)24/h1-2,9-14,20-24H,3H2,(H,16,17)(H,18,19)/t9-,10+,11-,12+,13-,14+
InChIKey: IZWPESYNFHLISZ-LRRLDJKKSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Triglochin maritima | Triglochin | Juncaginaceae | Alismatales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 359.28700000000015
TPSA？: 208.77
MolLogP？: -2.91712
Number of H-Donors: 7
Number of H-Acceptors: 9
RingCount: 1
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|