Molecule

Broussonetine O

AlkaPlorer ID: AK049848

Synonym: '(+)-Broussonetine O'

IUPAC Name: (E)-13-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-1-hydroxytridec-10-en-4-one

Structure

SMILES: O=C(CCCO)CCCCC/C=C/CC[C@H]1N[C@H](CO)[C@H](O)[C@@H]1O

InChI: InChI=1S/C18H33NO5/c20-12-8-10-14(22)9-6-4-2-1-3-5-7-11-15-17(23)18(24)16(13-21)19-15/h3,5,15-21,23-24H,1-2,4,6-13H2/b5-3+/t15-,16-,17-,18+/m1/s1

InChIKey: QBJZCPGUZSTYAG-BXAMOFRCSA-N

Reference

Studies on the Constituents of Broussonetia Species VIII. Four New Pyrrolidine Alkaloids, Broussonetines R, S, T, and V and a New Pyrroline Alkaloid, Broussonetine U, from Broussonetia kazinoki SIEB.

PubChem CID: 101096783

LOTUS: LTS0145847

NPASS: NPC188875

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Broussonetia kazinoki	Broussonetia	Moraceae	Rosales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 343.46400000000006

TPSA？: 110.02

MolLogP？: 0.6693999999999996

Number of H-Donors: 5

Number of H-Acceptors: 6

RingCount: 1

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi