Guanylin
[CAS# 140653-38-9]

Identification

• Name: Guanylin
• Synonyms: Guanylin (Rat Reduced)
• Molecular Formula: C₆₀H₉₄N₁₆O₂₂S₄
• Molecular Weight: 1519.74
• CAS Registry Number: 140653-38-9
• SMILES: [C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1NCCC1)CC(=O)N)[C@H](O)C)CS)CCC(=O)O)(C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)O)CS)[C@H](O)C)CS)C)C)CC2=CC=C(O)C=C2)C)CS)[C@H](CC)C
• InChI: 1S/C60H94N16O22S4/c1-8-25(2)44(74-51(88)34(15-16-43(82)83)68-55(92)38(22-100)73-59(96)46(30(7)78)76-53(90)36(19-41(61)80)70-50(87)33-10-9-17-62-33)58(95)72-37(21-99)54(91)66-28(5)48(85)69-35(18-31-11-13-32(79)14-12-31)52(89)65-26(3)47(84)64-27(4)49(86)71-39(23-101)56(93)75-45(29(6)77)57(94)63-20-42(81)67-40(24-102)60(97)98/h11-14,25-30,33-40,44-46,62,77-79,99-102H,8-10,15-24H2,1-7H3,(H2,61,80)(H,63,94)(H,64,84)(H,65,89)(H,66,91)(H,67,81)(H,68,92)(H,69,85)(H,70,87)(H,71,86)(H,72,95)(H,73,96)(H,74,88)(H,75,93)(H,76,90)(H,82,83)(H,97,98)/t25-,26-,27-,28-,29+,30+,33-,34-,35-,36-,37-,38-,39-,40-,44-,45-,46-/m0/s1
• InChIKey: SULKGYKWHKPPKO-RAJPIYRYSA-N

Properties

• Density: 1.381g/cm³ (Cal.)
• Boiling point: 1949.909°C at 760 mmHg (Cal.)
• Flash point: 1133.064°C (Cal.)