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Basic information
- CAS
548-90-3- Standard SMILES
CC(C)[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23- InChIKey
SOODLZHDDSGRKL-FOOXYVKASA-N- Molecular formula
- C18H27NO6
- Average molar mass
- 353.415 g/mol
- Monoisotopic mass
- 353.18383758
Names & identifiers
- Preferred name
- Trichodesmine
- IUPAC
- (3R,4R,5R,13aR,13bR)-4,5-Dihydroxy-4,5-dimethyl-3-(propan-2-yl)-4,5,8,10,12,13,13a,13b-octahydro-2H-[1,6]dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3H)-dione
- English name
- trichodesmine
- Molecular formula
- C18H27NO6
- Molecular weight
- 353.41
Names & synonyms
Trichodesmine (Standard)(3R,4R,5R,8a1R,13aR)-4,5-dihydroxy-3-isopropyl-4,5-dimethyl-4,5,8,8a1,10,12,13,13a-octahydro-2H-[1,6]dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3H)-dione2H-[1,6]Dioxacycloundecino[2,3,4-gh]pyrrolizine-2,6(3H)-dione, 4,5,8,10,12,13,13a,13b-octahydro-4,5-dihydroxy-4,5-dimethyl-3-(1-methylethyl)-, (3R,4R,5R,13aR,13bR)-
Database identifiers
- CAS
548-90-3- PubChem CID
- 119040
- DTXSID
DTXSID50970148- ChEMBL
CHEMBL1573073- EC Number
- 111-078-1
Properties
Physicochemical properties
- Melting point
- 160 · 160-161 °C (decomp)
- Boiling point
- 546.5 · 546.5±50.0 °C(Predicted)
- Density
- 1.29 · 1.29±0.1 g/cm3(Predicted)
- pka
- 12.19 · 12.19±0.60(Predicted)
- RIDADR
- 1544 · 1544
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 1544
- hazard_class
- 6.1(b)
- packing_group
- III
Chemistry & industry
Applications
UsesTrichodesmine is a pyrrolizidine alkaloid that has neurotoxic effects and is naturally found in Crotolaria argyptiaca, a shrub plant that is native to the south eastern desert of Egypt. Trichodesmine is also known to have toxic effects on pyrrole binding and Glutathione (G597951) metabolism in the rat.
Suppliers23 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
武汉天植生物技术有限公司18607101326 15172504745 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
BOC Sciences[email protected]
爱必信（上海）生物科技有限公司13761418683 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
南京狄尔格医药科技有限公司025-025-51191215 18013836722 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
四川恒诚致远生物科技有限公司18113192475 18113192475 · [email protected]
常州翔龙医药科技有限公司18661161657 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
上海安谱实验科技股份有限公司18502138905 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海智溯科生物科技有限公司021-58056897 15399714481 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
Related reactions
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No reaction records under the current filter.
Compound notes
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