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Euonymine

AlkaPlorer ID: AK037582

Synonym: 'Euonymin', 'Euonimine', '(1S,3R,13S,14S,17S,18R,19R,20R,21S,22R,23R,24R,25R)-20-(Acetoxymethyl)-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo15.7.1.01,20.03,23.07,12pentacosa-7,9,11-trien e-18,19,21,22,24-pentayl pentaacetate', '7-epi-euonymine', '7-epi-Euonymine', 'Euonymine'

IUPAC Name: [(1R,3S,13R,14R,17R,18S,19S,20S,21S,22R,23S,24S,25S)-18,19,21,22,24-pentaacetyloxy-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-20-yl]methyl acetate

Structure

SMILES: CC(=O)OC[C@@]12[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]3[C@H](OC(C)=O)[C@]14O[C@]3(C)COC(=O)C1=CC=CN=C1[C@H](C)[C@@H](C)C(=O)O[C@H]([C@@H](OC(C)=O)[C@H]2OC(C)=O)[C@]4(C)O

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InChI: InChI=1S/C38H47NO18/c1-16-17(2)33(46)56-30-28(52-20(5)42)32(55-23(8)45)37(15-49-18(3)40)31(54-22(7)44)27(51-19(4)41)25-29(53-21(6)43)38(37,36(30,10)48)57-35(25,9)14-50-34(47)24-12-11-13-39-26(16)24/h11-13,16-17,25,27-32,48H,14-15H2,1-10H3/t16-,17-,25+,27-,28-,29+,30-,31-,32-,35-,36+,37+,38-/m1/s1

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InChIKey: PBFGAFDJVQAMRS-LBGWBQJVSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Tripterygium wilfordii Tripterygium Celastraceae Celastrales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 805.7830000000004

TPSA？: 252.75

MolLogP？: 1.0335000000000052

Number of H-Donors: 1

Number of H-Acceptors: 19

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information