Deidaclin
AlkaPlorer ID: AK002484
Synonym: '', '(S)-Tetraphyllin A', 'Deidaclin'
IUPAC Name: (1R)-1-[(2S,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=CCC1
InChI: InChI=1S/C12H17NO6/c13-6-12(3-1-2-4-12)19-11-10(17)9(16)8(15)7(5-14)18-11/h1,3,7-11,14-17H,2,4-5H2/t7-,8-,9+,10-,11+,12+/m1/s1
InChIKey: HBCFZAXOSTUEHA-ZSOJELSESA-N
Reference
Tetraphyllins A and B, deidaclin and epitetraphyllin B from Tetrapathaea tetrandra (Passifloraceae)
PubChem CID: 73604
CAS: 88824-26-4
LOTUS: LTS0103659
SuperNatural Ⅲ: SN0120753-03
NPASS: NPC60520
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Taxus wallichiana | Taxus | Taxaceae | Cupressales | Pinopsida | Streptophyta | Viridiplantae | Eukaryota |
Properties Information
Molecule Weight: 271.26900000000006
TPSA？: 123.17000000000002
MolLogP？: -1.58472
Number of H-Donors: 4
Number of H-Acceptors: 7
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|