Compound Summary
Compound Information
sobuzoxane
Compound Name: | sobuzoxane |
Compound CID: | 5233 |
Synonyms: | sobuzoxane 98631-95-9 MST 16 4-2-4-(2-methylpropoxycarbonyloxymethyl)-3,5-dioxopiperazin-1-ylethyl-2,6-dioxopiperazin-1-ylmethyl 2-methylpropyl carbonate UNII-R1308VH37P More... |
Iupac Name: | [4-[2-[4-(2-methylpropoxycarbonyloxymethyl)-3,5-dioxopiperazin-1-yl]ethyl]-2,6-dioxopiperazin-1-yl]methyl 2-methylpropyl carbonate |
InChI: | InChI=1S/C22H34N4O10/c1-15(2)11-33-21(31)35-13-25-17(27)7-23(8-18(25)28)5-6-24-9-19(29)26(20(30)10-24)14-36-22(32)34-12-16(3)4/h15-16H,5-14H2,1-4H3 |
InChIKey: | OCOKWVBYZHBHLU-UHFFFAOYSA-N |
Canonical Smiles: | CC(C)COC(=O)OCN1C(=O)CN(CC1=O)CCN2CC(=O)N(C(=O)C2)COC(=O)OCC(C)C |
Isomeric Smiles: | CC(C)COC(=O)OCN1C(=O)CN(CC1=O)CCN2CC(=O)N(C(=O)C2)COC(=O)OCC(C)C |
Molecular Weight: | 514.5 |
Molecular Formula: | C22H34N4O10 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
sobuzoxane
Molecular Weight: | 514.5 |
Molecular Formula: | C22H34N4O10 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 12 |
Rotatable Bond Count: | 15 |
Heavy Atom Count: | 36 |
Complexity: | 743 |
Synonyms
sobuzoxane
| sobuzoxane | sobuzoxane |
|---|---|
sobuzoxane |
98631-95-9 |
MST 16 |
4-2-4-(2-methylpropoxycarbonyloxymethyl)-3,5-dioxopiperazin-1-ylethyl-2,6-dioxopiperazin-1-ylmethyl 2-methylpropyl carbonate |
UNII-R1308VH37P |
Perazolin |
R1308VH37P |
NCGC00015954-02 |
Sobuzoxano |
Sobuzoxanum |
MST-16 |
Sobuzoxane INN:JAN |
Sobuzoxanum INN-Latin |
4,4-(1,2-Ethanediyl)bis(1-iso-butoxycarbonyloxmethyl-2,6-piperazinedione) |
Sobuzoxano INN-Spanish |
BRN 6031322 |
Perazolin (TN) |
Sobuzoxane (JAN) |
Lopac-S-4692 |
1,2-Bis(4-isobutoxycarbonyloxymethyl-3,5-dioxo-piperazin-1-yl)ethane |
4,4-Ethylenebis(1-(hydroxymethyl)-2,6-piperazinedione) bis(isobutyl carbonate) (ester) |
DSSTox_CID_25203 |
DSSTox_RID_80747 |
DSSTox_GSID_45203 |
Lopac0_001094 |
SCHEMBL18416 |
MLS002153414 |
CHEMBL1256871 |
DTXSID5045203 |
CHEBI:32136 |
HMS2230C04 |
HMS3263K10 |
HMS3369L07 |
Tox21_110265 |
Tox21_501094 |
MFCD00866498 |
ZINC22032147 |
Sobuzoxane, >=99% (HPLC), solid |
CCG-205171 |
LP01094 |
SDCCGSBI-0051064.P002 |
NCGC00015954-01 |
NCGC00015954-03 |
NCGC00015954-04 |
NCGC00094367-01 |
NCGC00094367-02 |
NCGC00261779-01 |
Carbonic acid, 1,2-ethanediylbis((2,6-dioxo-4,1-piperazinediyl)methylene)bis(2-methylpropyl) ester |
SMR001230790 |
CAS-98631-95-9 |
EU-0101094 |
1-N-TRITYL-IMIDAZOLE-2-YLPROPIONICACID |
D01404 |
F52515 |
S 4692 |
33985-EP2272827A1 |
33985-EP2275420A1 |
33985-EP2295055A2 |
33985-EP2295416A2 |
33985-EP2295426A1 |
33985-EP2295427A1 |
33985-EP2298748A2 |
33985-EP2298764A1 |
33985-EP2298765A1 |
33985-EP2298768A1 |
33985-EP2305642A2 |
33985-EP2311453A1 |
33985-EP2311808A1 |
33985-EP2311829A1 |
631S959 |
A839107 |
SR-01000075401 |
SR-01000075401-2 |
Q27287640 |
4,4-(1,2-Ethanediyl)bis(1-isobutoxycarbonyloxymethyl-2,6-piperazinedione)" |
(4,4-(ethane-1,2-diyl)bis(2,6-dioxopiperazine-4,1-diyl))bis(methylene) isobutyl dicarbonate |
4-2-4-(2-methylpropoxycarbonyloxymethyl)-3,5-bis(oxidanylidene)piperazin-1-ylethyl-2,6-bis(oxidanylidene)piperazin-1-ylmethyl 2-methylpropyl carbonate |
4-2-4-(2-Methylpropoxycarbonyloxymethyl)-3,5-dioxo-piperazin-1-ylethyl-2,6-dioxo-piperazin-1-ylmethyl 2-methylpropyl carbonate |
carbonic acid 4-2-4-2-methylpropoxy(oxo)methoxymethyl-3,5-dioxo-1-piperazinylethyl-2,6-dioxo-1-piperazinylmethyl 2-methylpropyl ester |
Experimental Data
sobuzoxane
| 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 | 33 | umol/L | 6 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
sobuzoxane
Statistics Data
sobuzoxane
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 6 | 1 | 1 |
Statistics Data Visualization
sobuzoxane
