Compound Summary
Compound Information
ISOMITRAPHYLLINE
Compound Name: | ISOMITRAPHYLLINE |
Compound CID: | 11726520 |
Synonyms: | ISOMITRAPHYLLINE 4963-01-3 UNII-XKC69MV51V XKC69MV51V Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (7alpha,19alpha)- More... |
Iupac Name: | methyl (1S,4aS,5aS,6S,10aR)-1-methyl-2'-oxospiro[1,4a,5,5a,7,8,10,10a-octahydropyrano[3,4-f]indolizine-6,3'-1H-indole]-4-carboxylate |
InChI: | InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13-,14+,18-,21-/m0/s1 |
InChIKey: | JMIAZDVHNCCPDM-NWQITLLVSA-N |
Canonical Smiles: | CC1C2CN3CCC4(C3CC2C(=CO1)C(=O)OC)C5=CC=CC=C5NC4=O |
Isomeric Smiles: | C[C@H]1[C@H]2CN3CC[C@@]4([C@@H]3C[C@@H]2C(=CO1)C(=O)OC)C5=CC=CC=C5NC4=O |
Molecular Weight: | 368.4 |
Molecular Formula: | C21H24N2O4 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
ISOMITRAPHYLLINE
Molecular Weight: | 368.4 |
Molecular Formula: | C21H24N2O4 |
Hydrogen Bond Donor Count: | 1 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 27 |
Complexity: | 692 |
Synonyms
ISOMITRAPHYLLINE
| ISOMITRAPHYLLINE | ISOMITRAPHYLLINE |
|---|---|
ISOMITRAPHYLLINE |
4963-01-3 |
UNII-XKC69MV51V |
XKC69MV51V |
Formosanan-16-carboxylic acid, 19-methyl-2-oxo-, methyl ester, (7alpha,19alpha)- |
Isomitraphyllin |
7-Isomitraphylline |
Ajmalicine oxindole A |
SCHEMBL23259271 |
ZINC4995171 |
Isomitraphylline (constituent of cats claw) DSC |
Q27293881 |
(1S,3S,4aS,5aS,10aR)-methyl 1-methyl-2-oxo-1,4a,5,5a,7,8,10,10a-octahydrospiroindoline-3,6-pyrano3,4-findolizine-4-carboxylate" |
methyl (1S,4aS,5aS,6S,10aR)-1-methyl-2-oxospiro1,4a,5,5a,7,8,10,10a-octahydropyrano3,4-findolizine-6,3-1H-indole-4-carboxylate" |
Experimental Data
ISOMITRAPHYLLINE
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 10 | ug/mL | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 1 | ug/mL | Unclear | N2 | 33683565 | ||||||||
| Caenorhabditis elegans | 2 | ug/mL | Unclear | N2 | 33683565 |
Experimental Data Visualization
ISOMITRAPHYLLINE
Statistics Data
ISOMITRAPHYLLINE
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 1 | 3 |
Statistics Data Visualization
ISOMITRAPHYLLINE
