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MART-1 (27-35) (human)

CAT: 0121-4095854.0005Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0121-4095854.0005Size:5 mg
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CAS Number
156251-11-5
Specifications
H-7734.0005
Synonyms
Melan A MART-1 (27-35), human
Sequence
H-Ala-Ala-Gly-Ile-Gly-Ile-Leu-Thr-Val-OH
Molecular Formula
C₃₇H₆₇N₉O₁₁
Molecular Weight
813.99
Shipping Conditions
Ambient Temperature
Storage Temperature
< -15°C

Chemical Information

Melan A
CAS Number156251-11-5
PubChem CID146157413
IUPAC Nameacetic acid;2-[[2-[[2-[[2-[[2-[[2-[[2-[2-(2-aminopropanoylamino)propanoylamino]acetyl]amino]-3-methylpentanoyl]amino]acetyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]-3-methylbutanoic acid
Molecular FormulaC39H71N9O13
Molecular Weight874.0
Topological Polar Surface Area354
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count14
Rotatable Bond Count25
Heavy Atom Count61
Formal Charge0
Complexity1440
SMILES
CCC(C)C(C(=O)NCC(=O)NC(C(C)CC)C(=O)NC(CC(C)C)C(=O)NC(C(C)O)C(=O)NC(C(C)C)C(=O)O)NC(=O)CNC(=O)C(C)NC(=O)C(C)N.CC(=O)O
InChI
InChI=1S/C37H67N9O11.C2H4O2/c1-12-19(7)28(43-25(48)15-39-32(51)22(10)41-31(50)21(9)38)34(53)40-16-26(49)44-29(20(8)13-2)35(54)42-24(14-17(3)4)33(52)46-30(23(11)47)36(55)45-27(18(5)6)37(56)57;1-2(3)4/h17-24,27-30,47H,12-16,38H2,1-11H3,(H,39,51)(H,40,53)(H,41,50)(H,42,54)(H,43,48)(H,44,49)(H,45,55)(H,46,52)(H,56,57);1H3,(H,3,4)
InChIKey
DJBCPXAFOLJFOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Melan A
CAS: 156251-11-5
CID: 146157413
Formula: C39H71N9O13
MW: 874.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight874.0
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count14
Rotatable Bond Count25
Exact Mass873.51713335
Monoisotopic Mass873.51713335
Topological Polar Surface Area354 Ų
Heavy Atom Count61
Formal Charge0
Complexity1440
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count10
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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