Cetrorelix DiAcetate

Product Name Cetrorelix DiAcetate
Alternate Names Cetrorelix Impurities, Impurities of Cetrorelix
CAT No. CS-EO-01600
CAS No. 130143-01-0
Category Impurities
Stock Enquire
Mol. Wt. 1473.07 g/mol
Mol. For. C72H94ClN17O15
Hazardous This is not a Hazardous Compound
COA View Sample COA
MSDS View Sample MSDS
Parent API Cetrorelix
Canonical Smiles CC(C)CC(C(=O)NC(CCCN=C(N)N)C(=O)N1CCCC1C(=O)NC(C)C(=O)N)NC(=O)C(CCCNC(=O)N)NC(=O)C(CC2=CC=C(C=C2)O)NC(=O)C(CO)NC(=O)C(CC3=CN=CC=C3)NC(=O)C(CC4=CC=C(C=C4)Cl)NC(=O)C(CC5=CC6=CC=CC=C6C=C5)NC(=O)C
InchIKey SBNPWPIBESPSIF-MHWMIDJBSA-N
Inchl InChI=1S/C70H92ClN17O14/c1-39(2)31-52(61(94)82-51(15-9-28-77-69(73)74)68(101)88-30-10-16-58(88)67(100)79-40(3)59(72)92)83-60(93)50(14-8-29-78-70(75)102)81-63(96)54(34-43-20-25-49(91)26-21-43)86-66(99)57(38-89)87-65(98)56(36-45-11-7-27-76-37-45)85-64(97)55(33-42-18-23-48(71)24-19-42)84-62(95)53(80-41(4)90)35-44-17-22-46-12-5-6-13-47(46)32-44/h5-7,11-13,17-27,32,37,39-40,50-58,89,91H,8-10,14-16,28-31,33-36,38H2,1-4H3,(H2,72,92)(H,79,100)(H,80,90)(H,81,96)(H,82,94)(H,83,93)(H,84,95)(H,85,97)(H,86,99)(H,87,98)(H4,73,74,77)(H3,75,78,102)/t40-,50-,51+,52+,53-,54+,55-,56-,57+,58+/m1/s1
IUPAC (2S)-1-[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-acetamido-3-naphthalen-2-ylpropanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-pyridin-3-ylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-5-(carbamoylamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-N-[(2R)-1-amino-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
Controlled No
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Related Compounds

Cetrorelix Impurity 9 | Impurity 4-D-Ser Cetrorelix | Impurity AC-L-Nal Cetrorelix | Endo(3)-D-Pal- Cetrorelix | Impurity L-Pal Cetrorelix | Impurity pCl-L-Phe Cetrorelix | Cetrorelix Impurity 7 + OH | Cetrorelix Impurity 22 | Impurity D Acetyl-Ser4- Cetrorelix | Impurity L-Cit-Cetrorelix | L-Ala Cetrorelix | Cetrorelix Impurity 23 |

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