Gynocardin
AlkaPlorer ID: AK024556
Synonym: '2-Cyclopentene-1-carbonitrile, 1-(beta-D-glucopyranosyloxy)-4,5-dihydroxy-,(1alpha,4alpha,5beta)-', 'Gynocardin'
IUPAC Name: (1R,4R,5S)-4,5-dihydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carbonitrile
Structure
SMILES: N#C[C@]1(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C[C@@H](O)[C@@H]1O
InChI: InChI=1S/C12H17NO8/c13-4-12(2-1-5(15)10(12)19)21-11-9(18)8(17)7(16)6(3-14)20-11/h1-2,5-11,14-19H,3H2/t5-,6-,7-,8+,9-,10+,11-,12-/m1/s1
InChIKey: HASDUOHKNMHNJA-JGZJKUPSSA-N
Reference
Gynocardin in Ceratiosicyos laevis (achariaceae)
PubChem CID: 163035124
LOTUS: LTS0040757
SuperNatural Ⅲ: SN0120454-02
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Ceratiosicyos laevis | Ceratiosicyos | Achariaceae | Malpighiales | Magnoliopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 303.26700000000005
TPSA？: 163.63
MolLogP？: -3.64312
Number of H-Donors: 6
Number of H-Acceptors: 9
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
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