7-(dimethylamino)-5-methoxy-1,2,3-benzotrithiol-4-ol

AlkaPlorer ID: AK146756

Synonym: None

IUPAC Name: 7-(dimethylamino)-5-methoxy-1,2,3-benzotrithiol-4-ol

Structure

SMILES: COC1=CC(N(C)C)=C2SSSC2=C1O

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InChI: InChI=1S/C9H11NO2S3/c1-10(2)5-4-6(12-3)7(11)9-8(5)13-15-14-9/h4,11H,1-3H3

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InChIKey: ZJGGUEDMOWKIIO-UHFFFAOYSA-N

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Reference

PubChem CID: 163077815

SuperNatural Ⅲ: SN0471892

NPASS: NPC18793

COCONUT: CNP0380684

Source

Species Genus Family Order Class Phylum Kingdom Domain
Crataegus cuneata Crataegus Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 261.393

TPSA: 32.7

MolLogP: 3.2278000000000016

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information