Mastoparan

CAT: 0931-TP1386-02Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0931-TP1386-02Size:5 mg

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CAS Number

72093-21-1

Target

Endogenous Metabolite

Related Pathways

Metabolism

Bioactivity

Mastoparan is a peptide toxin from wasp venom. It has the chemical structure Ile-Asn-Leu-Lys-Ala-Leu-Ala-Ala-Leu-Ala-Lys-Lys-Ile-Leu-NH2.

Smiles

[C@H](C(N[C@H](C(N[C@@H](CC(C)C)C(N)=O)=O)[C@H](CC)C)=O)(NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@H]([C@H](CC)C)N)=O)CC(N)=O)=O)CC(C)C)=O)CCCCN)=O)C)=O)CC(C)C)=O)C)=O)C)=O)CC(C)C)=O)C)=O)CCCCN)=O)CCCCN

Molecular Formula

C70H131N19O15

Molecular Weight

1478.91

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Mastoparan

Mastoparan is a peptide toxin produced from the venom of the hornet (Vespa analis). (T170)

CAS Number	72093-21-1
PubChem CID	5464497
IUPAC Name	(2S)-N-[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-amino-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]-2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]butanediamide
Molecular Formula	C70H131N19O15
Molecular Weight	1478.9
XLogP	1
Topological Polar Surface Area	569
Hydrogen Bond Donor Count	19
Hydrogen Bond Acceptor Count	19
Rotatable Bond Count	53
Heavy Atom Count	104
Formal Charge	0
Complexity	2790

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C(C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N)N

InChI

InChI=1S/C70H131N19O15/c1-17-40(11)55(75)69(103)88-53(35-54(74)90)68(102)87-52(34-39(9)10)67(101)83-46(25-19-22-28-71)62(96)78-45(16)61(95)86-50(32-37(5)6)65(99)79-42(13)58(92)77-43(14)60(94)85-51(33-38(7)8)66(100)80-44(15)59(93)81-47(26-20-23-29-72)63(97)82-48(27-21-24-30-73)64(98)89-56(41(12)18-2)70(104)84-49(57(76)91)31-36(3)4/h36-53,55-56H,17-35,71-73,75H2,1-16H3,(H2,74,90)(H2,76,91)(H,77,92)(H,78,96)(H,79,99)(H,80,100)(H,81,93)(H,82,97)(H,83,101)(H,84,104)(H,85,94)(H,86,95)(H,87,102)(H,88,103)(H,89,98)/t40-,41?,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,55-,56-/m0/s1

InChIKey

MASXKPLGZRMBJF-HDSAQESISA-N

Chemical Structure

2D Structure

CAS: 72093-21-1

CID: 5464497

Formula: C70H131N19O15

MW: 1478.9

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1478.9
XLogP3	1
Hydrogen Bond Donor Count	19
Hydrogen Bond Acceptor Count	19
Rotatable Bond Count	53
Exact Mass	1478.00720455
Monoisotopic Mass	1478.00720455
Topological Polar Surface Area	569 Å²
Heavy Atom Count	104
Formal Charge	0
Complexity	2790
Isotope Atom Count	0
Defined Atom Stereocenter Count	15
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
B6627-1	Mastoparan

Mastoparan

Chemical Information

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