Molecule

Erysothiovine

AlkaPlorer ID: AK169834

Synonym: ''

IUPAC Name: 2-[[(2R,13bS)-2,11-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-12-yl]oxysulfonyl]acetic acid

Structure

SMILES: COC1=C(OS(=O)(=O)CC(=O)O)C=C2C(=C1)CCN1CC=C3C=C[C@H](OC)C[C@]321

InChI: InChI=1S/C20H23NO7S/c1-26-15-4-3-14-6-8-21-7-5-13-9-17(27-2)18(10-16(13)20(14,21)11-15)28-29(24,25)12-19(22)23/h3-4,6,9-10,15H,5,7-8,11-12H2,1-2H3,(H,22,23)/t15-,20-/m0/s1

InChIKey: TZPLXTDTCOMZQQ-YWZLYKJASA-N

Reference

Erythrina Alkaloids. XIV. Isolation and Characterization of Erysothiovine and Erysothiopine, New Alkaloids Containing Sulfur<sup>1a</sup>

PubChem CID: 131879512

LOTUS: LTS0138056

SuperNatural Ⅲ: SN0364417-01

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Erythrina fusca	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 421.4710000000002

TPSA？: 102.37

MolLogP？: 1.4567

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi