Elatoside L

Representations & DB's id
ChEBI:	None
ChEMBL:	CHEMBL1834950
PubChem:	56662699
IUPAC:	(2S,3S,4S,5R,6R)-6-[[(3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxycarbonyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3-[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy-4-hydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxyoxane-2-carboxylic acid
Standard InChI:	InChI=1S/C65H104O33/c1-60(2)14-16-65(59(86)98-57-47(82)42(77)38(73)30(93-57)23-88-54-45(80)40(75)35(70)27(20-67)90-54)17-15-63(6)24(25(65)18-60)8-9-32-62(5)12-11-33(61(3,4)31(62)10-13-64(32,63)7)94-58-50(48(83)49(51(97-58)52(84)85)95-55-43(78)36(71)28(21-68)91-55)96-56-46(81)41(76)37(72)29(92-56)22-87-53-44(79)39(74)34(69)26(19-66)89-53/h8,25-51,53-58,66-83H,9-23H2,1-7H3,(H,84,85)/t25-,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-,53+,54+,55-,56-,57-,58+,62-,63+,64+,65-/m0/s1
Standard InChI Key:	HRATWECYMQTNMX-USHHFQQESA-N
SMILES:	OC[C@@H]1O[C@H]([C@@H]([C@H]1O)O)O[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O)O[C@H]1CC[C@]2([C@H](C1(C)C)CC[C@@]1([C@@H]2CC=C2[C@@]1(C)CC[C@@]1([C@H]2CC(C)(C)CC1)C(=O)O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@H]([C@@H]([C@H]2O)O)O)[C@H]([C@@H]([C@H]1O)O)O)C)C)C(=O)O

Molecular propeties
AlogP:	4.22
Hydrogen bonds acceptors:	2
Hydrogen bonds donors:	2
Rotatable bonds:	5
Number of rings:	11
Molecular Weight:	1412.65
Topological polar surface area:	529
Number of aromatic rings:	0
Fsp3:	0.938
Number of carbons:	65

Plant sources

Part of plant	Plant name	Ref.
Plant	Aralia elata

In vitro data

Activity Type	Activity Value	Target Name	UniProt ID	Ref.