alpha-Chaconine

Type : Natural,Alkaloid,Glycoside

Chemical_Nomenclature : (2S,3R,4R,5R,6S)-2-[(2R,3S,4S,5R,6R)-4-hydroxy-2-(hydroxymethyl)-6-[[(1S,2S,7S,10R,11S,14S,15R,16S,17R,20S,23S)-10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.02,11.05,10.015,23.017,22]tetracos-4-en-7-yl]oxy]-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol

Canonical SMILES : CC1CCC2C(C3C(N2C1)CC4C3(CCC5C4CC=C6C5(CCC(C6)OC7C(C(C(C(O7)CO)OC8C(C(C(C(O8)C)O)O)O)O)OC9C(C(C(C(O9)C)O)O)O)C)C)C

InChI : InChI=1S\/C45H73NO14\/c1-19-7-10-28-20(2)31-29(46(28)17-19)16-27-25-9-8-23-15-24(11-13-44(23,5)26(25)12-14-45(27,31)6)57-43-40(60-42-37(53)35(51)33(49)22(4)56-42)38(54)39(30(18-47)58-43)59-41-36(52)34(50)32(48)21(3)55-41\/h8,19-22,24-43,47-54H,7,9-18H2,1-6H3\/t19-,20+,21-,22-,24-,25+,26-,27-,28+,29-,30+,31-,32-,33-,34+,35+,36+,37+,38-,39+,40+,41-,42-,43+,44-,45-\/m0\/s1

InChIKey : TYNQWWGVEGFKRU-AJDPQWBVSA-N

Other name(s) : 5QOL0LIM81,Chaconine,UNII-5QOL0LIM81,CCRIS 6509,BRN 0077396,AC1L9DRN,CHEBI:10219,beta-D-Glucopyranoside, (3beta)-solanid-5-en-3-yl O-6-deoxy-alpha-L-mannopyranosyl-(1-2)-O-(6-deoxy-alpha-L-mannopyranosyl-(1-4))-

MW : 852.07

Formula : C45H73NO14

CAS_number : 20562-03-2

PubChem : 442971

UniChem : TYNQWWGVEGFKRU-AJDPQWBVSA-N

IUPHAR :

Wikipedia : Chaconine

Families : alpha-Chaconine ligand of proteins in family: BCHE

Stucture :

Protein :