Drosulfakinin 1
[CAS# 117457-90-6]

Identification

• Name: Drosulfakinin 1
• Synonyms: Dsk-1; Drosulfakinin 1; Drosulfakinin I
• Molecular Formula: C₅₆H₇₃N₁₅O₁₆S
• Molecular Weight: 1244.34
• CAS Registry Number: 117457-90-6
• SMILES: [C@H](C(NCC(=O)O)=O)(NC([C@@H](NC([C@@H](NC([C@@H](NC(CNC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CC1=CC=CC=C1)=O)CC(=O)O)=O)CC(=O)O)=O)CC2=CC=C(O)C=C2)=O)=O)CC3C=NC=N3)=O)CCSC)=O)CCCNC(=N)N)=O)CC4=CC=CC=C4
• InChI: 1S/C56H73N15O16S/c1-88-20-18-38(52(84)66-37(13-8-19-61-56(58)59)51(83)69-39(50(82)63-29-47(78)79)22-32-11-6-3-7-12-32)67-53(85)41(24-34-27-60-30-64-34)65-44(73)28-62-49(81)40(23-33-14-16-35(72)17-15-33)70-55(87)43(26-46(76)77)71-54(86)42(25-45(74)75)68-48(80)36(57)21-31-9-4-2-5-10-31/h2-7,9-12,14-17,27,30,34,36-43,72H,8,13,18-26,28-29,57H2,1H3,(H,62,81)(H,63,82)(H,65,73)(H,66,84)(H,67,85)(H,68,80)(H,69,83)(H,70,87)(H,71,86)(H,74,75)(H,76,77)(H,78,79)(H4,58,59,61)/t34?,36-,37-,38-,39-,40-,41-,42-,43-/m0/s1
• InChIKey: FMKJGDDKLFOKKG-UJIYZKTISA-N

Properties

• Density: 1.49g/cm³ (Cal.)