CS-0532722
(S)-1-((3S,6S,9S,12S,15S,18S,21S)-3-((1H-Imidazol-5-yl)methyl)-6-((1H-indol-3-yl)methyl)-21-(3-guanidinopropyl)-12-(4-hydroxybenzyl)-9-(hydroxymethyl)-15,18-diisobutyl-1,4,7,10,13,16,19-heptaoxo-1-((S)-5-oxopyrrolidin-2-yl)-2,5,8,11,14,17,20-heptaazadocosan-22-oyl)-N-ethylpyrrolidine-2-carboxamide (Leuprorelin Leuprolide) Impurity
Manufacturer: ChemScene
CAS Number: 54785-87-4
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₅₉H₈₄N₁₆O₁₂
Molecular Weight
1209.40
Synonyms
Leuoprorelin
SMILES
O=C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N(CCC1)[C@@H]1C(NCC)=O)=O)=O)=O)=O)CC(C=C2)=CC=C2O)=O)[C@@H](NC([C@@H](NC([C@@H](N3)CCC3=O)=O)CC4=CN=CN4)=O)CC5=CNC6=CC=CC=C56
Tpsa
429.04
Logp
-1.22843
H Acceptors
14
H Donors
16
Rotatable Bonds
32
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 54785-87-4 | (Des-Gly10,Leu6,Pro-NHEt 9)-LHRH trifluoroacetate salt Pyr-His-Trp-Ser-Tyr-Leu-Leu-Arg-Pro-NHEt trifluoroacetate salt | A2B Chem | ₹ 59,720.88 |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/health-hazard.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₉H₈₄N₁₆O₁₂
Molecular Weight: 1209.40
Synonyms: Leuoprorelin
SMILES: O=C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N(CCC1)[C@@H]1C(NCC)=O)=O)=O)=O)=O)CC(C=C2)=CC=C2O)=O)[C@@H](NC([C@@H](NC([C@@H](N3)CCC3=O)=O)CC4=CN=CN4)=O)CC5=CNC6=CC=CC=C56
Tpsa: 429.04
Logp: -1.22843
H Acceptors: 14
H Donors: 16
Rotatable Bonds: 32
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₉H₈₄N₁₆O₁₂
Molecular Weight:
1209.40
Synonyms:
Leuoprorelin
SMILES:
O=C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N(CCC1)[C@@H]1C(NCC)=O)=O)=O)=O)=O)CC(C=C2)=CC=C2O)=O)[C@@H](NC([C@@H](NC([C@@H](N3)CCC3=O)=O)CC4=CN=CN4)=O)CC5=CNC6=CC=CC=C56
Tpsa:
429.04
Logp:
-1.22843
H Acceptors:
14
H Donors:
16
Rotatable Bonds:
32
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₂H₂₇ClO₄
Molecular Weight: 390.90
Synonyms: 17α-Hydroxy-21-chloro-9β,11β-epoxy-16α-methylpregna-1,4-diene-3,20-dione
SMILES: C[C@@]12[C@@]34[C@](CCC1=CC(C=C2)=O)([H])[C@@]5([H])[C@](C[C@]3([H])O4)([C@](O)([C@@H](C5)C)C(CCl)=O)C
Tpsa: 66.9
Logp: 3.2106
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₂H₂₇ClO₄
Molecular Weight:
390.90
Synonyms:
17α-Hydroxy-21-chloro-9β,11β-epoxy-16α-methylpregna-1,4-diene-3,20-dione
SMILES:
C[C@@]12[C@@]34[C@](CCC1=CC(C=C2)=O)([H])[C@@]5([H])[C@](C[C@]3([H])O4)([C@](O)([C@@H](C5)C)C(CCl)=O)C
Tpsa:
66.9
Logp:
3.2106
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅₉H₈₄N₁₆O₁₂
Molecular Weight: 1209.40
Synonyms: Leuprorelin EP Impurity E
SMILES: O=C([C@@H]1CCC(N1)=O)N[C@@H](CC2=CN=CN2)C(N[C@@H](C(N[C@@H](CO)C(N[C@H](C(N[C@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N3[C@@H](CCC3)C(NCC)=O)=O)=O)=O)=O)CC4=CC=C(C=C4)O)=O)=O)CC5=CNC6=CC=CC=C56)=O
Tpsa: 429.04
Logp: -1.22843
H Acceptors: 14
H Donors: 16
Rotatable Bonds: 32
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅₉H₈₄N₁₆O₁₂
Molecular Weight:
1209.40
Synonyms:
Leuprorelin EP Impurity E
SMILES:
O=C([C@@H]1CCC(N1)=O)N[C@@H](CC2=CN=CN2)C(N[C@@H](C(N[C@@H](CO)C(N[C@H](C(N[C@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N3[C@@H](CCC3)C(NCC)=O)=O)=O)=O)=O)CC4=CC=C(C=C4)O)=O)=O)CC5=CNC6=CC=CC=C56)=O
Tpsa:
429.04
Logp:
-1.22843
H Acceptors:
14
H Donors:
16
Rotatable Bonds:
32
Purity: 98%
MDL No: MFCD32741245
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₈O₃
Molecular Weight: 128.13
Synonyms: None
SMILES: OC([C@]12[C@](COC2)([H])C1)=O
Tpsa: 46.53
Logp: 0.1075
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
MFCD32741245
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₈O₃
Molecular Weight:
128.13
Synonyms:
None
SMILES:
OC([C@]12[C@](COC2)([H])C1)=O
Tpsa:
46.53
Logp:
0.1075
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
1