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Melanotan (MT) -II

CAT: 0127-BUP02167-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP02167-01Size:5 mg
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CAS Number
121062-08-6
Purity
=98%
Smiles
C(C=1C=2C(NC1)=CC=CC2)[C@@H]3NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](CC4=CC=CC=C4)NC(=O)[C@H](CC5=CN=CN5)NC(=O)[C@@H](NC([C@H](CCCC)NC(C)=O)=O)CC(=O)NCCCC[C@@H](C(N)=O)NC3=O

Chemical Information

melanotan-II

Melanotan II is an organic molecular entity.

CAS Number121062-08-6
PubChem CID92432
IUPAC Name(3S,6S,9R,12S,15S,23S)-15-[[(2S)-2-acetamidohexanoyl]amino]-9-benzyl-6-[3-(diaminomethylideneamino)propyl]-12-(1H-imidazol-5-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexazacyclotricosane-23-carboxamide
Molecular FormulaC50H69N15O9
Molecular Weight1024.2
XLogP0
Topological Polar Surface Area385
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count11
Rotatable Bond Count17
Heavy Atom Count74
Formal Charge0
Complexity1950
SMILES
CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CC2=CN=CN2)CC3=CC=CC=C3)CCCN=C(N)N)CC4=CNC5=CC=CC=C54)C(=O)N)NC(=O)C
InChI
InChI=1S/C50H69N15O9/c1-3-4-16-36(59-29(2)66)44(69)65-41-25-42(67)55-20-11-10-18-35(43(51)68)60-47(72)39(23-31-26-57-34-17-9-8-15-33(31)34)63-45(70)37(19-12-21-56-50(52)53)61-46(71)38(22-30-13-6-5-7-14-30)62-48(73)40(64-49(41)74)24-32-27-54-28-58-32/h5-9,13-15,17,26-28,35-41,57H,3-4,10-12,16,18-25H2,1-2H3,(H2,51,68)(H,54,58)(H,55,67)(H,59,66)(H,60,72)(H,61,71)(H,62,73)(H,63,70)(H,64,74)(H,65,69)(H4,52,53,56)/t35-,36-,37-,38+,39-,40-,41-/m0/s1
InChIKey
JDKLPDJLXHXHNV-MFVUMRCOSA-N
Chemical Structure
2D Structure
2D structure of melanotan-II
CAS: 121062-08-6
CID: 92432
Formula: C50H69N15O9
MW: 1024.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1024.2
XLogP30
Hydrogen Bond Donor Count13
Hydrogen Bond Acceptor Count11
Rotatable Bond Count17
Exact Mass1023.54026884
Monoisotopic Mass1023.54026884
Topological Polar Surface Area385 Ų
Heavy Atom Count74
Formal Charge0
Complexity1950
Isotope Atom Count0
Defined Atom Stereocenter Count7
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
5-01537Melanotan II, MT-Ⅱ
GTR18918764-01Melanotan (MT) -II
MBS3612232-01Melanotan(MT)-II
E-PP-1534-01Melanotan II, MT-
MBS5763586Melanotan (MT)-II
GWB-476D2DMelanotan II (MT-II)
PT_41498-01Melanotan-II (MT II)
GTR19067322-01Melanotan II, MT-II
ML10Melanotan Il MT-2 (Melanotan 2 Acetate)
PT_41499-01Melanotan-I (MT I)

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