Ramorelix
[CAS# 127932-90-5]

Identification

• Name: Ramorelix
• Synonyms: Hoe 013; L-Proline, 1-(N2-(N-(N-(N-(N-(N-(N-(N-Acetyl-3-(1-Naphthalenyl)-D-Alanyl)-4-Chloro-D-Phenylalanyl)-D-Tryptophyl)-L-Seryl)-L-Tyrosyl)-O-(6-Deoxy-Alpha-L-Mannopyranosyl)-D-Seryl)-L-Leucyl)-L-Arginyl)-, 2-(Aminocarbonyl)Hydrazide; Ramorelix
• Molecular Formula: C₇₄H₉₅ClN₁₆O₁₈
• Molecular Weight: 1532.11
• CAS Registry Number: 127932-90-5 (136639-71-9)
• SMILES: [C@@]1(C(=O)NNC(=O)N)(N(CCC1C([C@H](NC(=O)C)CC3=CC=C2C=CC=CC2=C3)=O)C([C@@H](NC([C@@H](NC([C@H](N)CO[C@H]4[C@H](O)[C@H](O)[C@@H](O)[C@@H](O4)C)=O)CC(C)C)=O)CCCNC(=N)N)=O)C([C@@H](NC([C@@H](NC([C@H](NC([C@H](N)CC5=CC=C(C=C5)Cl)=O)CC6=C[NH]C7=CC=CC=C67)=O)CO)=O)CC8=CC=C(O)C=C8)=O
• InChI: 1S/C74H95ClN16O18/c1-37(2)28-56(86-65(101)51(77)36-108-70-62(98)61(97)59(95)38(3)109-70)66(102)84-53(14-9-26-81-72(78)79)69(105)91-27-25-49(60(96)54(83-39(4)93)32-42-15-20-43-10-5-6-11-44(43)29-42)74(91,71(106)89-90-73(80)107)63(99)55(31-41-18-23-47(94)24-19-41)85-68(104)58(35-92)88-67(103)57(33-45-34-82-52-13-8-7-12-48(45)52)87-64(100)50(76)30-40-16-21-46(75)22-17-40/h5-8,10-13,15-24,29,34,37-38,49-51,53-59,61-62,70,82,92,94-95,97-98H,9,14,25-28,30-33,35-36,76-77H2,1-4H3,(H,83,93)(H,84,102)(H,85,104)(H,86,101)(H,87,100)(H,88,103)(H,89,106)(H4,78,79,81)(H3,80,90,107)/t38-,49?,50+,51+,53-,54+,55-,56-,57+,58-,59-,61+,62+,70+,74+/m0/s1
• InChIKey: UBJQGMTUZITZCE-QDKKYJHVSA-N

Properties

• Density: 1.51g/cm³ (Cal.)