Hediamine

AlkaPlorer ID: AK300074

Synonym: None

IUPAC Name: None

Structure

SMILES: COC1=CC=C2C=C3C4=CC5=C(C=C4CCN3C(=O)CC2=C1OC)OCO5

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InChI: InChI=1S/C21H19NO5/c1-24-17-4-3-12-7-16-14-9-19-18(26-11-27-19)8-13(14)5-6-22(16)20(23)10-15(12)21(17)25-2/h3-4,7-9H,5-6,10-11H2,1-2H3

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InChIKey: PHIWVMCLRRZZLJ-UHFFFAOYSA-N

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Reference

CAS: 183162-31-4

Source

Properties Information

Molecule Weight: 365.38500000000016

TPSA: 57.23

MolLogP: 2.8714000000000013

Number of H-Donors: 0

Number of H-Acceptors: 5

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information