Lanatoside E

CAT: 0013-GTR19199064Size: 25 mgDry Ice: NoHazardous: No

1 / 1

CAT#:0013-GTR19199064Size:25 mg

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

Description

Lanatoside E is a cyclic triterpenoid saponin investigated for its antitumor properties. Research applications include in vitro studies on cancer cell lines and in vivo models to explore its mechanisms and potential therapeutic efficacy.

CAS Number

20460-30-4

Smiles

CC1OC (CC (O) C1OC1CC (O) C (OC2CC (OC (C) =O) C (OC3OC (CO) C (O) C (O) C3O) C (C) O2) C (C) O1) OC1CCC2 (C) C (CCC3C2CCC2 (C) C (C (CC32O) OC=O) C2=CC (=O) OC2) C1 |t:71|

Molecular Formula

C50H76O21

Molecular Weight

1013.137

Storage Conditions

-20°C

Notes

For research use only.

Chemical Information

Lanatoside E

lanatoside e has been reported in Digitalis lanata with data available.

CAS Number	20460-30-4
PubChem CID	15560068
IUPAC Name	[(2R,3R,4S,6S)-6-[(2R,3S,4S,6S)-6-[(2R,3S,4S,6R)-6-[[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-16-formyloxy-14-hydroxy-10,13-dimethyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-hydroxy-2-methyloxan-3-yl]oxy-4-hydroxy-2-methyloxan-3-yl]oxy-2-methyl-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-4-yl] acetate
Molecular Formula	C50H76O21
Molecular Weight	1013.1
XLogP	0.6
Topological Polar Surface Area	294
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	21
Rotatable Bond Count	14
Heavy Atom Count	71
Formal Charge	0
Complexity	1940

SMILES

C[C@@H]1[C@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC=O)O)C)C)O)O[C@H]7C[C@@H]([C@@H]([C@H](O7)C)O[C@H]8C[C@@H]([C@@H]([C@H](O8)C)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)OC(=O)C)O

InChI

InChI=1S/C50H76O21/c1-22-44(69-38-16-32(55)45(23(2)64-38)70-39-17-33(66-25(4)53)46(24(3)65-39)71-47-43(59)42(58)41(57)35(19-51)68-47)31(54)15-37(63-22)67-28-9-11-48(5)27(14-28)7-8-30-29(48)10-12-49(6)40(26-13-36(56)61-20-26)34(62-21-52)18-50(30,49)60/h13,21-24,27-35,37-47,51,54-55,57-60H,7-12,14-20H2,1-6H3/t22-,23-,24-,27-,28+,29+,30-,31+,32+,33+,34+,35-,37+,38+,39+,40+,41-,42+,43-,44-,45-,46-,47+,48+,49-,50+/m1/s1

InChIKey

YMKWEJBJAVBYHU-SBTGRVASSA-N

Chemical Structure

2D Structure

CAS: 20460-30-4

CID: 15560068

Formula: C50H76O21

MW: 1013.1

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1013.1
XLogP3	0.6
Hydrogen Bond Donor Count	7
Hydrogen Bond Acceptor Count	21
Rotatable Bond Count	14
Exact Mass	1012.48790943
Monoisotopic Mass	1012.48790943
Topological Polar Surface Area	294 Å²
Heavy Atom Count	71
Formal Charge	0
Complexity	1940
Isotope Atom Count	0
Defined Atom Stereocenter Count	26
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
GTR19199065	Lanatoside
GTR19174241-01	Lanatoside C
GTR19163493-01	Lanatoside C
GTR19221803-01	Lanatoside D
GTR19183369	Lanatoside B
GTR19175912-01	(E, E) -RAMB4
GTR19229853-01	(E, E) -Farnesol
GTR19277617-01	9 (E),11 (E),13 (E),15 (E) -Octadecatetraenoic acid
GTR19233427-01	(E, E, E, ) -10,12,14-Hexadecatrienal
GTR19253806-01	(E, E) -Farnesyl bromide

Alternative Products

Catalog	Name
MBS5775335	Lanatoside
T1670-01	Lanatoside C
MBS5775336	Lanatoside E
MBS5760573	Lanatoside B

Lanatoside E

Chemical Information

Related Products

Alternative Products

Popular Products