Products for Research Use Only
RegisterLogin

7α-O-Ethylmorroniside

CAT: 0804-HY-N11659-01Size: 1 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-N11659-01Size:1 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
7α-O-Ethylmorroniside is an iridoid[1].
CAS Number
1116650-29-3
UNSPSC
12352005
Target
Others
Type
Natural Products
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/7α-o-ethylmorroniside.html
Solubility
10 mM in DMSO
Smiles
COC(C1=CO[C@H]([C@@]2([H])[C@]1([H])C[C@H](O[C@H]2C)OCC)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)=O
Molecular Formula
C19H30O11
Molecular Weight
434.43
References & Citations
[1]Bingyou Yang, et al. Root bark of Sambucus Williamsii Hance promotes rat femoral fracture healing by the BMP-2/Runx2 signaling pathway. J Ethnopharmacol. 2016 Sep 15;191:107-114.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

7alpha-O-Ethylmorroniside
CAS Number1116650-29-3
PubChem CID145963539
IUPAC Namemethyl (1S,3S,4aS,8S,8aS)-3-ethoxy-1-methyl-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,4a,8,8a-hexahydropyrano[3,4-c]pyran-5-carboxylate
Molecular FormulaC19H30O11
Molecular Weight434.4
XLogP-0.9
Topological Polar Surface Area153
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Heavy Atom Count30
Formal Charge0
Complexity626
SMILES
CCO[C@@H]1C[C@H]2[C@@H]([C@@H](O1)C)[C@@H](OC=C2C(=O)OC)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O
InChI
InChI=1S/C19H30O11/c1-4-26-12-5-9-10(17(24)25-3)7-27-18(13(9)8(2)28-12)30-19-16(23)15(22)14(21)11(6-20)29-19/h7-9,11-16,18-23H,4-6H2,1-3H3/t8-,9+,11+,12-,13+,14+,15-,16+,18-,19-/m0/s1
InChIKey
IRKFOLIBBQDADK-HWCWTJPSSA-N
Chemical Structure
2D Structure
2D structure of 7alpha-O-Ethylmorroniside
CAS: 1116650-29-3
CID: 145963539
Formula: C19H30O11
MW: 434.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight434.4
XLogP3-0.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass434.17881177
Monoisotopic Mass434.17881177
Topological Polar Surface Area153 Ų
Heavy Atom Count30
Formal Charge0
Complexity626
Isotope Atom Count0
Defined Atom Stereocenter Count10
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-N166437-O-Ethylepirosmanol
HY-N7655-017-O-Methylbiochanin A
HY-N2158-017-O-Methylmangiferin
HY-N133817-O-Prenylscopoletin
HY-N6008A7β-O-Methylmorroniside
HY-N22147-O-Methylaloeresin A
HY-N11539-017-O-Primverosylpseudobaptigenin
HY-N11892-017-O-Methylaloesinol
HY-1369997-O-Methyleucomol
HY-N150677-O-Methylluteone

Alternative Products

CatalogName
439813-017-O-Ethylmorroniside
T126384-017α-O-Ethylmorroniside
GTR192068977-α-O-Ethylmorroniside
3711277-O-Ethylmorroniside discontinued
MBS57918317alpha-O-Ethylmorroniside
CS-T-933247-O-Desmethyl-7-O-ethyl Everolimus
AR-R01235-017-O-Demethyl-7-O-ethyl Rapamycin
439812-017-O-Desmethoxy-7-O-chloroethyl Erlotinib Hydrochloride
BA8667-17-O-Methylaloesinol
BCA85711-017-O-Methyleriodictyol

Popular Products