Ligand Information
Ligand General Information | Top | |||
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Ligand ID |
LAYX72
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Ligand Name |
Digitonin
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Synonyms |
Digitonin; 11024-24-1; Digitin; Digitogenin, glycoside; KOO5CM684H; Digitonine; UNII-KOO5CM684H; NSC23471; NSC-23471; EINECS 234-255-6; MFCD00077729; NSC 23471; BRN 0078654; DIGITONIN [MI]; AI3-44893; Digitonin - water-soluble; Digitonin - water-insoluble; 5-19-03-00603 (Beilstein Handbook Reference); Digitonin, ~50% (TLC); SCHEMBL13839328; beta-D-Galactopyranoside, (2alpha,3beta,5alpha,15beta,25R)-2,15-dihydroxyspirostan-3-yl O-beta-D-glucopyranosyl-(1-3)-O-beta-D-galactopyranosyl-(1-2)-O-(beta-D-xylopyranosyl-(1-3))-O-beta-D-glucopyranosyl-(1-4)-; HY-N4000; AKOS015915861; Digitonin, Used as non-ionic detergent; Digitonin - stable clear, water-soluble; XD175328; XD175329; XD175416; CS-0023339; D78276; (2.Alpha.,3.beta.,5.alpha.,15.beta.,16.beta.,25R)-2,15-Dihydroxyspirostan-3-yl .beta.-D-glucopyranosyl-(1->3)-.beta.-D-galactopyranosyl-(1->2)-[.beta.-D-xylopyranosyl-(1->3)]-.beta.-D-glucopyranosyl-(1->4)-.beta.-D-galactopyranoside; beta-D-Galactopyranoside, (2alpha,3beta,5alpha,15beta,25R)-2,15-dihydroxyspirostan-3-yl O-beta-D-glucopyranosyl-(1->3)-O-beta-D-galactopyranosyl-(1->2)-O-(beta-D-xylopyranosyl-(1->3))-O-beta-D-glucopyranosyl-(1->4)-; beta-D-Galactopyranoside, (2alpha,3beta,5alpha,15beta,25R)-2,15-dihydroxyspirostan-3-yl O-beta-D-glucopyranosyl-(1.fwdarw.3)-O-beta-D-galactopyranosyl-(1.fwdarw.2)-O-(beta-D-xylopyranosyl-(1.fwdarw.3))-O-beta-D-glucopyranosyl-(1.fwdarw.4)-
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Structure |
Download2D MOL
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Formula |
C56H92O29
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Canonical SMILES |
CC1CCC2(C(C3C(O2)C(C4C3(CCC5C4CCC6C5(CC(C(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)CO)O)OC9C(C(C(CO9)O)O)O)OC2C(C(C(C(O2)CO)O)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)O)C)C)O)C)OC1
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InChI |
1S/C56H92O29/c1-19-7-10-56(75-17-19)20(2)31-45(85-56)37(67)32-22-6-5-21-11-26(24(61)12-55(21,4)23(22)8-9-54(31,32)3)76-50-42(72)39(69)44(30(16-60)80-50)81-53-48(47(36(66)29(15-59)79-53)83-49-40(70)33(63)25(62)18-74-49)84-52-43(73)46(35(65)28(14-58)78-52)82-51-41(71)38(68)34(64)27(13-57)77-51/h19-53,57-73H,5-18H2,1-4H3/t19-,20+,21+,22-,23+,24-,25-,26-,27-,28-,29-,30-,31+,32-,33+,34-,35+,36-,37+,38+,39-,40-,41-,42-,43-,44+,45-,46+,47+,48-,49+,50-,51+,52+,53+,54-,55+,56-/m1/s1
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InChIKey |
UVYVLBIGDKGWPX-KUAJCENISA-N
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PubChem Compound ID |
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