Products for Research Use Only
RegisterLogin

Trachelanthamine

CAT: 0931-TN5158-02Size: 5 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0931-TN5158-02Size:5 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
14140-18-2
Target
Others
Related Pathways
Others
Bioactivity
Trachelanthamine is a natural product from Eupatorium fortunei.
Smiles
C(OC([C@](C(C)C)([C@@H](C)O)O)=O)[C@H]1[C@]2(N(CC1)CCC2)[H]
Molecular Formula
C15H27NO4
Molecular Weight
285.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Trachelanthamine
CAS Number14140-18-2
PubChem CID26477
IUPAC Name[(1S,8S)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]methyl (2R)-2-hydroxy-2-(1-hydroxyethyl)-3-methylbutanoate
Molecular FormulaC15H27NO4
Molecular Weight285.38
XLogP1.4
Topological Polar Surface Area70
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count20
Formal Charge0
Complexity360
SMILES
CC(C)[C@@](C(C)O)(C(=O)OC[C@H]1CCN2[C@H]1CCC2)O
InChI
InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11?,12-,13+,15-/m1/s1
InChIKey
BWQSLRZZOVFVHJ-VYHDIPPYSA-N
Chemical Structure
2D Structure
2D structure of Trachelanthamine
CAS: 14140-18-2
CID: 26477
Formula: C15H27NO4
MW: 285.38
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight285.38
XLogP31.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass285.19400834
Monoisotopic Mass285.19400834
Topological Polar Surface Area70 Ų
Heavy Atom Count20
Formal Charge0
Complexity360
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TC0014-01Trachelanthine
T124710-01Trachelanthamidine

Alternative Products

CatalogName
HY-N8623Trachelanthamine

Popular Products