Basic information
- CAS
143129-01-5- Standard SMILES
O=C(O)NCCC(=O)NCCSSCCNC(=O)CCNC(=O)O- InChIKey
NXURKZIMAQBJEU-UHFFFAOYSA-N- Molecular formula
- C12H22N4O6S2
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.09807678
Overview
structure given in first source
Names & identifiers
- Preferred name
- Vitalethine
- IUPAC
- [3-[2-[2-[3-(carboxyamino)propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]carbamic acid
- English name
- vitalethine
- Molecular formula
- C12H22N4O6S2
- Molecular weight
- 382.46
Names & synonyms
Vitalethine143129-01-5DTXSID301623229,10-Dithia-2,6,13,17-tetraazaoctadecanedioic acid, 5,14-dioxo-RefChem:194519DTXCID9084813[3-[2-[2-[3-(carboxyamino)propanoylamino]ethyldisulfanyl]ethylamino]-3-oxopropyl]carbamic acid9,10-Dithia-2,6,13,17-tetraazaoctadecanedioicacid, 5,14-dioxo-3,3'-(Dithiodi-2,1-ethanediylamino)bis(N-(3-oxopropyl)carbamic acid)(((Disulfanediylbis(ethane-2,1-diyl))bis(azanediyl))bis(3-oxopropane-3,1-diyl))dicarbamic acidThiol N-(carboxy)-beta-alanylcysteamineSCHEMBL7256000
Show more names
NXURKZIMAQBJEU-UHFFFAOYSA-NTFA12901DB-2493655,14-Dioxo-9,10-dithia-2,6,13,17-tetraazaoctadecanedioic Acid{Disulfanediylbis[ethane-2,1-diylazanediyl(3-oxopropane-3,1-diyl)]}dicarbamic acid
Database identifiers
- CAS
143129-01-5
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 207 Ų
- Hydrogen bond donors
- 6
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- Density
- 1.399 · 1.399±0.06 g/cm3(Predicted)
- pka
- 5.12 · 5.12±0.41(Predicted)
Chemistry & industry
Applications
UsesVitalethine is used to control erythropoiesis and neoplasia in subjects.
Suppliers3 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
2 records
Compound notes
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