Preimplantation factor
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-3-methylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid
Molecular Identity
Preimplantation factor
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-6-amino-2-[[(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-6-amino-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylsulfanylbutanoyl]amino]-3-methylbutanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-hydroxypropanoyl]amino]propanoyl]amino]-4-oxobutanoyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxypropanoyl]amino]-3-carboxypropanoyl]amino]butanedioic acid
PubChem CID: 134687212
2D Structure
Properties
C67H115N21O23S
Molecular Formula
1614.80
Molecular Weight
g/mol
1613.8195
Exact Mass
Da
-15
XLogP
Drug-like (Lipinski: < 5)
753
TPSA
May have limited oral absorption
23
H-Bond Donors
28
H-Bond Acceptors
3300
Complexity
SMILES
Canonical SMILES
SMILES: CCC(C)C(C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)NCC(=O)NC(CO)C(=O)NC(C)C(=O)NC(CC(=O)N)C(=O)NC(CCCCN)C(=O)N2CCCC2C(=O)NC(CO)C(=O)NC(CC(=O)O)C(=O)NC(CC(=O)O)C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C(C(C)C)NC(=O)C(CCSC)NIsomeric SMILES
SMILES: CC[C@H](C)[C@@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CCCCN)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCSC)NSynonyms(19)
Preimplantation factorUNII-3K6A6FJ98OPreimplantation factor, syntheticL-ASPARTIC ACID, L-METHIONYL-L-VALYL-L-ARGINYL-L-ISOLEUCYL-L-LYSYL-L-PROLYLGLYCYL-L-SERYL-L-ALANYL-L-ASPARAGINYL-L-LYSYL-L-PROLYL-L-SERYL-L-.ALPHA.-ASPARTYL-L-Aspartic acid, L-methionyl-L-valyl-L-arginyl-L-isoleucyl-L-lysyl-L-prolylglycyl-L-seryl-L-alanyl-L-asparaginyl-L-lysyl-L-prolyl-L-seryl-L-alpha-aspartyl-L-METHIONYL-L-VALYL-L-ARGINYL-L-ISOLEUCYL-L-LYSYL-L-PROLYLGLYCYL-L-SERYL-L-ALANYL-L-ASPARAGINYL-L-LYSYL-L-PROLYL-L-SERYL-L-.ALPHA.-ASPARTYL-L-ASPARTIC ACIDL-Methionyl-L-valyl-L-arginyl-L-isoleucyl-L-lysyl-L-prolylglycyl-L-seryl-L-alanyl-L-asparaginyl-L-lysyl-L-prolyl-L-seryl-L-alpha-aspartyl-L-aspartic acidPIF-1 PeptideRefChem:175858Preimplantation Factor PIF-1PIF-13K6A6FJ98OSynthetic preimplantation factor485818-40-4SPIF peptide
Data from PubChem (NCBI)
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