Molecule

Sarmentosin

AlkaPlorer ID: AK041972

Synonym: '', '2-Butenenitrile,4-(beta-D-glucopyranosyloxy)-2-(hydroxymethyl)-, (E)-', 'Sarmentosin'

IUPAC Name: (Z)-2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile

SMILES: N#C/C(=C/CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)CO

InChI: InChI=1S/C11H17NO7/c12-3-6(4-13)1-2-18-11-10(17)9(16)8(15)7(5-14)19-11/h1,7-11,13-17H,2,4-5H2/b6-1-/t7-,8-,9+,10-,11-/m1/s1

InChIKey: FWAYDNJCBHNWQD-JVNCHOTKSA-N

PubChem CID: 6438710

CAS: 71933-54-5

LOTUS: LTS0222878

NPASS: NPC178209

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Adonis amurensis	Adonis	Ranunculaceae	Ranunculales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Piper nigrum	Piper	Piperaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Ribes fasciculatum	Ribes	Grossulariaceae	Saxifragales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Rhodiola sacra	Rhodiola	Crassulaceae	Saxifragales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Cynanchum rostellatum	Cynanchum	Apocynaceae	Gentianales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Sedum sarmentosum	Sedum	Crassulaceae	Saxifragales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Piper sarmentosum	Piper	Piperaceae	Piperales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Molecule Weight: 275.25700000000006

TPSA？: 143.4

MolLogP？: -2.754819999999999

Number of H-Donors: 5

Number of H-Acceptors: 8

RingCount: 1

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi