Alatusamine

AlkaPlorer ID: AK120011

Synonym: '(8alpha)-8-(Acetyloxy)-8-deoxo-4-deoxyevonimine', '4-Deoxyeuonine'

IUPAC Name: [(1S,3R,15S,18R,19S,20R,21R,22S,23R,24R,25R,26R)-19,20,22,23,25-pentaacetyloxy-3,15,26-trimethyl-6,16-dioxo-2,5,17-trioxa-11-azapentacyclo[16.7.1.01,21.03,24.07,12]hexacosa-7(12),8,10-trien-21-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=C1CC[C@H](C)C(=O)O[C@@H]([C@H](OC(C)=O)[C@@H]2OC(C)=O)[C@H]4C

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InChI: InChI=1S/C38H47NO17/c1-17-12-13-26-25(11-10-14-39-26)35(47)49-15-36(9)27-29(50-20(4)41)32(53-23(7)44)37(16-48-19(3)40)33(54-24(8)45)30(51-21(5)42)28(55-34(17)46)18(2)38(37,56-36)31(27)52-22(6)43/h10-11,14,17-18,27-33H,12-13,15-16H2,1-9H3/t17-,18+,27+,28+,29+,30-,31+,32+,33-,36-,37+,38+/m0/s1

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InChIKey: SGYXRITWGDMMSS-AZVKVMJOSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Euonymus alatus Euonymus Celastraceae Celastrales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 789.7840000000002

TPSA: 232.51999999999995

MolLogP: 1.7477000000000038

Number of H-Donors: 0

Number of H-Acceptors: 18

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information