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Prepro VIP (156-170) (human)

CAT: 0926-FP110396-01Size: 2000 µgDry Ice: NoHazardous: No
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CAT#:0926-FP110396-01Size:2000 µg
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CAS Number
107902-86-3
Synonyms
H-Ser-Ser-Glu-Gly-Glu-Ser-Pro-Asp-Phe-Pro-Glu-Glu-Leu-Glu-Lys-OH; H-SSEGESPDFPEELEK-OH
MDL Number
MFCD00076541
Smiles
CC (C) C[C@@H] (C (=O) N[C@@H] (CCC (=O) O) C (=O) N[C@@H] (CCCCN) C (=O) O) NC (=O) [C@H] (CCC (=O) O) NC (=O) [C@H] (CCC (=O) O) NC (=O) [C@@H]1CCCN1C (=O) [C@H] (CC2=CC=CC=C2) NC (=O) [C@H] (CC (=O) O) NC (=O) [C@@H]3CCCN3C (=O) [C@H] (CO) NC (=O) [C@H] (CCC (=O) O) NC (=O) CNC (=O) [C@H] (CCC (=O) O) NC (=O) [C@H] (CO) NC (=O) [C@H] (CO) N
Molecular Formula
C71H106N16O31
Molecular Weight
1,679.69 g/mol
Controlled
No

Chemical Information

Prepro VIP (156-170) (human)
CAS Number107902-86-3
PubChem CID92044032
IUPAC Name(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-hydroxypropanoyl]amino]-4-carboxybutanoyl]amino]acetyl]amino]-4-carboxybutanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-carboxypropanoyl]amino]-3-phenylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-carboxybutanoyl]amino]-4-carboxybutanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]hexanoic acid
Molecular FormulaC71H106N16O31
Molecular Weight1679.7
XLogP-12.5
Topological Polar Surface Area764
Hydrogen Bond Donor Count24
Hydrogen Bond Acceptor Count33
Rotatable Bond Count55
Heavy Atom Count118
Formal Charge0
Complexity3560
SMILES
CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H]3CCCN3C(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)N
InChI
InChI=1S/C71H106N16O31/c1-35(2)28-44(64(110)78-40(17-22-54(96)97)62(108)80-43(71(117)118)12-6-7-25-72)81-63(109)41(18-23-55(98)99)77-61(107)42(19-24-56(100)101)79-67(113)49-13-8-26-86(49)69(115)46(29-36-10-4-3-5-11-36)83-65(111)45(30-57(102)103)82-68(114)50-14-9-27-87(50)70(116)48(34-90)85-60(106)39(16-21-53(94)95)75-51(91)31-74-59(105)38(15-20-52(92)93)76-66(112)47(33-89)84-58(104)37(73)32-88/h3-5,10-11,35,37-50,88-90H,6-9,12-34,72-73H2,1-2H3,(H,74,105)(H,75,91)(H,76,112)(H,77,107)(H,78,110)(H,79,113)(H,80,108)(H,81,109)(H,82,114)(H,83,111)(H,84,104)(H,85,106)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)(H,102,103)(H,117,118)/t37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-/m0/s1
InChIKey
ZFZRKFVGBLBUMC-PIPLXOIASA-N
Chemical Structure
2D Structure
2D structure of Prepro VIP (156-170) (human)
CAS: 107902-86-3
CID: 92044032
Formula: C71H106N16O31
MW: 1679.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1679.7
XLogP3-12.5
Hydrogen Bond Donor Count24
Hydrogen Bond Acceptor Count33
Rotatable Bond Count55
Exact Mass1678.7209906
Monoisotopic Mass1678.7209906
Topological Polar Surface Area764 Ų
Heavy Atom Count118
Formal Charge0
Complexity3560
Isotope Atom Count0
Defined Atom Stereocenter Count14
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

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V2115-01PVasoactive Intestinal Peptide (VIP/PHM), Prepro (156-170) (human)
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SP-89587-1Prepro VIP (156-170) (human) (AA: Ser-Ser-Glu-Gly-Glu-Ser-Pro-Asp-Phe-Pro-Glu-Glu-Leu-Glu-Lys) (MW: 1679.73)
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