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name Structure Reference Source Properties Activities Metabolism

Paravallarine

AlkaPlorer ID: AK002822

Synonym: None

IUPAC Name: None

Structure

SMILES: C[NH2+][C@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@@H]5[C@H](C)OC(=O)[C@@]54CC[C@@H]32)C1

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InChI: InChI=1S/C22H33NO2/c1-13-17-6-7-19-16-5-4-14-12-15(23-3)8-10-21(14,2)18(16)9-11-22(17,19)20(24)25-13/h4,13,15-19,23H,5-12H2,1-3H3/p+1/t13-,15-,16+,17+,18-,19-,21-,22-/m0/s1

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InChIKey: RSFPISDAJMWREU-CDFICMNGSA-O

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Reference

SuperNatural Ⅲ: SN0333878-03

NPASS: NPC233256

Source

Species Genus Family Order Class Phylum Kingdom Domain
Mentha suaveolens Mentha Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Elsholtzia stauntonii Elsholtzia Lamiaceae Lamiales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Flindersia australis Flindersia Rutaceae Sapindales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Piper hostmannianum Piper Piperaceae Piperales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Asparagus setaceus Asparagus Asparagaceae Asparagales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Heliotropium angiospermum Heliotropium Heliotropiaceae Boraginales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Kibatalia laurifolia Kibatalia Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Bidens parviflora Bidens Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Anisocycla grandidieri Anisocycla Menispermaceae Ranunculales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Alpinia formosana Alpinia Zingiberaceae Zingiberales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Protea compacta Protea Proteaceae Proteales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Holarrhena pubescens Holarrhena Apocynaceae Gentianales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Pinus bungeana Pinus Pinaceae Pinales Pinopsida Streptophyta Viridiplantae Eukaryota
Sorbus tianschanica Sorbus Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Zingiber officinale Zingiber Zingiberaceae Zingiberales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Typhonium flagelliforme Typhonium Araceae Alismatales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Rubus moluccanus Rubus Rosaceae Rosales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Bambusa tulda Bambusa Poaceae Poales Magnoliopsida Streptophyta Viridiplantae Eukaryota
Westiellopsis prolifica Westiellopsis Hapalosiphonaceae Nostocales Cyanophyceae Cyanobacteriota None Bacteria

Properties Information

Molecule Weight: 344.5190000000002

TPSA？: 42.91

MolLogP？: 3.052600000000001

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens KB IC50 12800.0 nM 10.1021/np200165t

Metabolism Information