Crebtide
[CAS# 149155-45-3]

Identification

• Name: Crebtide
• Synonyms: Krreilsrrpsyr
• Molecular Formula: C₇₃H₁₂₉N₂₉O₁₉
• Molecular Weight: 1717.01
• CAS Registry Number: 149155-45-3
• SMILES: [C@H](C(=O)O)(NC([C@@H](NC([C@@H](NC([C@H]1N(CCC1)C([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CCCCN)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)CCC(=O)O)=O)[C@H](CC)C)=O)CC(C)C)=O)CO)=O)CCCNC(=N)N)=O)CCCNC(=N)N)=O)=O)CO)=O)CC2=CC=C(O)C=C2)=O)CCCNC(=N)N
• InChI: 1S/C73H129N29O19/c1-5-39(4)55(101-60(112)46(25-26-54(106)107)94-58(110)44(16-9-29-87-70(78)79)92-57(109)43(15-8-28-86-69(76)77)91-56(108)42(75)14-6-7-27-74)66(118)98-49(34-38(2)3)61(113)99-51(36-103)63(115)93-45(17-10-30-88-71(80)81)59(111)95-47(18-11-31-89-72(82)83)67(119)102-33-13-20-53(102)65(117)100-52(37-104)64(116)97-50(35-40-21-23-41(105)24-22-40)62(114)96-48(68(120)121)19-12-32-90-73(84)85/h21-24,38-39,42-53,55,103-105H,5-20,25-37,74-75H2,1-4H3,(H,91,108)(H,92,109)(H,93,115)(H,94,110)(H,95,111)(H,96,114)(H,97,116)(H,98,118)(H,99,113)(H,100,117)(H,101,112)(H,106,107)(H,120,121)(H4,76,77,86)(H4,78,79,87)(H4,80,81,88)(H4,82,83,89)(H4,84,85,90)/t39-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,55-/m0/s1
• InChIKey: QKXYCULATRFTIQ-KPXMCYQPSA-N

Properties

• Density: 1.51g/cm³ (Cal.)