N-(5-Dimethylaminonaphthalene-1-Sulfonyl)-4-Aminophenyl-beta-Lactoside
[CAS# 94367-65-4]

Identification

• Name: N-(5-Dimethylaminonaphthalene-1-Sulfonyl)-4-Aminophenyl-beta-Lactoside
• Synonyms: N-[4-[(2S,3R,4R,6R)-3,4-Dihydroxy-6-(Hydroxymethyl)-5-[(2S,3R,4S,5R,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxyphenyl]-5-Dimethylamino-Naphthalene-1-Sulfonamide; N-[4-[[(2S,3R,4R,6R)-3,4-Dihydroxy-6-(Hydroxymethy
• Molecular Formula: C₃₀H₃₈N₂O₁₃S
• Molecular Weight: 666.70
• CAS Registry Number: 94367-65-4
• SMILES: [C@@H]5(OC1[C@H](O)[C@@H](O)[C@@H](O[C@@H]1CO)OC4=CC=C(N[S](=O)(=O)C2=CC=CC3=C(N(C)C)C=CC=C23)C=C4)O[C@@H]([C@H](O)[C@H](O)[C@H]5O)CO
• InChI: 1S/C30H38N2O13S/c1-32(2)19-7-3-6-18-17(19)5-4-8-22(18)46(40,41)31-15-9-11-16(12-10-15)42-29-27(39)25(37)28(21(14-34)44-29)45-30-26(38)24(36)23(35)20(13-33)43-30/h3-12,20-21,23-31,33-39H,13-14H2,1-2H3/t20-,21-,23+,24+,25-,26-,27-,28?,29-,30+/m1/s1
• InChIKey: XRZMMUOXWCCJGA-ULFRDAAFSA-N

Properties

• Density: 1.604g/cm³ (Cal.)
• Boiling point: 921.54°C at 760 mmHg (Cal.)
• Flash point: 511.129°C (Cal.)