Thiocolchicoside

• Catalog Number: ACM602415
• Product Name: Thiocolchicoside
• CAS: 602-41-5
• Category: Heterocyclic Organic Compound
• Synonyms: 10-Thiocolchicoside
• IUPAC Name: N-[(7S)-1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide
• Molecular Weight: 563.62
• Molecular Formula: C27H33NO10S
• Canonical SMILES: CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O
• InChI: InChI=1S/C27H33NO10S/c1-12(30)28-16-7-5-13-9-18(37-27-24(34)23(33)22(32)19(11-29)38-27)25(35-2)26(36-3)21(13)14-6-8-20(39-4)17(31)10-15(14)16/h6,8-10,16,19,22-24,27,29,32-34H,5,7,11H2,1-4H3,(H,28,30)/t16-,19+,22+,23-,24+,27+/m0/s1
• InChI Key: LEQAKWQJCITZNK-AXHKHJLKSA-N
• Boiling Point: 929.6±65.0 °C
• Melting Point: 190-198 °C
• Appearance: White powder
• pKa: 12.74±0.70

Custom Q&A

What is the molecular formula of thiocolchicoside?

The molecular formula of thiocolchicoside is C27H33NO10S.

What is the molecular weight of thiocolchicoside?

The molecular weight of thiocolchicoside is 563.6 g/mol.

What are the synonyms of thiocolchicoside?

The synonyms of thiocolchicoside include Coltramyl, Musco-ril, Coltrax, and more.

What is the IUPAC name of thiocolchicoside?

The IUPAC name of thiocolchicoside is N-[(7S)-1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide.

What is the InChIKey of thiocolchicoside?

The InChIKey of thiocolchicoside is LEQAKWQJCITZNK-AXHKHJLKSA-N.

What is the canonical SMILES of thiocolchicoside?

The canonical SMILES of thiocolchicoside is CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC4C(C(C(C(O4)CO)O)O)O.

What is the CAS number of thiocolchicoside?

The CAS number of thiocolchicoside is 602-41-5.

What is the UNII of thiocolchicoside?

The UNII of thiocolchicoside is T1X8S697GT.

What is the ChEMBL ID of thiocolchicoside?

The ChEMBL ID of thiocolchicoside is CHEMBL213907.

What is the Wikipedia page of thiocolchicoside?

The Wikipedia page of thiocolchicoside can be found at "Thiocolchicoside".