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name Structure Reference Source Properties Activities Metabolism

(1R,9S)-11-{[(1R,12R)-16-hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-2(10),3,8,13(18),14,16-hexaen-17-yl]methyl}-7,11-diazatricyclo[7.3.1.0²,⁷]trideca-2,4-dien-6-one

AlkaPlorer ID: AK221052

Synonym: None

IUPAC Name: (1R,9S)-11-[[(1R,12R)-16-hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-17-yl]methyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Structure

SMILES: O=C1C=CC=C2[C@@H]3C[C@@H](CN(CC4=C5OC[C@H]6C7=CC8=C(C=C7O[C@H]6C5=CC=C4O)OCO8)C3)CN21

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InChI: InChI=1S/C28H26N2O6/c31-22-5-4-17-27(33-13-20-18-7-24-25(35-14-34-24)8-23(18)36-28(17)20)19(22)12-29-9-15-6-16(11-29)21-2-1-3-26(32)30(21)10-15/h1-5,7-8,15-16,20,28,31H,6,9-14H2/t15-,16+,20-,28-/m0/s1

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InChIKey: JXSLKTOGVPMPCS-AIQFOMFISA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Sophora tonkinensis Sophora Fabaceae Fabales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 486.5240000000003

TPSA？: 82.39000000000001

MolLogP？: 3.5116000000000023

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information