Piperstachine; (E,E,E)-form 

AlkaPlorer ID: AK310589

Synonym: None

IUPAC Name: (2E,8E,10E)-11-(1,3-benzodioxol-5-yl)-N-(2-methylpropyl)undeca-2,8,10-trienamide

Structure

SMILES: CC(C)CN=C(O)/C=C/CCCC/C=C/C=C/C1=CC=C2OCOC2=C1

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InChI: InChI=1S/C22H29NO3/c1-18(2)16-23-22(24)12-10-8-6-4-3-5-7-9-11-19-13-14-20-21(15-19)26-17-25-20/h5,7,9-15,18H,3-4,6,8,16-17H2,1-2H3,(H,23,24)/b7-5+,11-9+,12-10+

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InChIKey: VGIPIHKQNLOKES-ZNOFIXJLSA-N

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Reference

PubChem CID: 21627815

CAS: 57155-80-3

SuperNatural Ⅲ: SN0389532-01

NPASS: NPC299099

Properties Information

Molecule Weight: 355.47800000000007

TPSA: 51.05000000000001

MolLogP: 5.713800000000005

Number of H-Donors: 1

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information