Molecule

(1S,4S)-4-hydroxy-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclopent-2-ene-1-carboxamide

AlkaPlorer ID: AK239367

Synonym: None

IUPAC Name: (1S,4S)-4-hydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopent-2-ene-1-carboxamide

Structure

SMILES: N=C(O)[C@@]1(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C[C@@H](O)C1

InChI: InChI=1S/C12H19NO8/c13-11(19)12(2-1-5(15)3-12)21-10-9(18)8(17)7(16)6(4-14)20-10/h1-2,5-10,14-18H,3-4H2,(H2,13,19)/t5-,6-,7-,8+,9-,10+,12-/m1/s1

InChIKey: DLTOXAHPWHUWNI-HRDYMGRSSA-N

Reference

Cyanogenesis of Adenia volkensii Harms and Tetrapathaea tetrandra Cheeseman (Passifloraceae) Revisited: Tetraphyllin B and Volkenin. Optical Rotatory Power of Cyclopentenoid Cyanohydrin Glucosides.

PubChem CID: 15596196

LOTUS: LTS0198953

SuperNatural Ⅲ: SN0069138-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Adenia volkensii	Adenia	Passifloraceae	Malpighiales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 305.2830000000001

TPSA？: 163.69

MolLogP？: -2.60223

Number of H-Donors: 7

Number of H-Acceptors: 8

RingCount: 2

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi