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Chemical structure of Hirsutine

GC36229

Hirsutine

Also known as methyl (E)-2-[(2S,3R,12bR)-3-ethyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoate

Hirsutine, an indole alkaloid of Uncaria rhynchophylla, exhibits anti-cancer activity

ChemicalCAS7729-23-9MW368.47FormulaC22H28N2O3
CAS number
7729-23-9
Molecular weight
368.47
Formula
C22H28N2O3
Solubility
DMSO ： 100 mg/mL (271·39 mM; Need ultrasonic)
InChIKey
NMLUOJBSAYAYEM-AZQGJTAVSA-N
Catalogue number
GC36229
Brand
GLPBIO
Computed properties PubChem CID 3037884 · XLogP 3.4 · TPSA 54.6 Ų · H-bond donors 1
XLogP
3.4
TPSA
54.6 Ų
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
27

SMILES CC[C@H]1CN2CCC3=C([C@H]2C[C@@H]1/C(=C\OC)/C(=O)OC)NC4=CC=CC=C34

Computed descriptors from PubChem (CID 3037884), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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