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FGF basic (119-126) (human, mouse, rabbit, rat)

CAT: 0926-FF108562-01Size: 1000 µgDry Ice: NoHazardous: No
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CAT#:0926-FF108562-01Size:1000 µg
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CAS Number
152051-61-1
Synonyms
H-Lys-Arg-Thr-Gly-Gln-Tyr-Lys-Leu-OH; H-KRTGQYKL-OH
MDL Number
MFCD00237000
Smiles
C[C@H] ([C@@H] (C (=O) NCC (=O) N[C@@H] (CCC (=O) N) C (=O) N[C@@H] (CC1=CC=C (C=C1) O) C (=O) N[C@@H] (CCCCN) C (=O) N[C@@H] (CC (C) C) C (=O) O) NC (=O) [C@H] (CCCN=C (N) N) NC (=O) [C@H] (CCCCN) N) O
Molecular Formula
C44H76N14O12
Molecular Weight
993.16 g/mol
Controlled
No

Chemical Information

(2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoic acid
CAS Number152051-61-1
PubChem CID10129746
IUPAC Name(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoic acid
Molecular FormulaC44H76N14O12
Molecular Weight993.2
XLogP-6.1
Topological Polar Surface Area467
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count16
Rotatable Bond Count35
Heavy Atom Count70
Formal Charge0
Complexity1730
SMILES
C[C@H]([C@@H](C(=O)NCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CCCCN)N)O
InChI
InChI=1S/C44H76N14O12/c1-24(2)21-33(43(69)70)57-38(64)29(10-5-7-19-46)55-41(67)32(22-26-12-14-27(60)15-13-26)56-39(65)31(16-17-34(48)61)53-35(62)23-52-42(68)36(25(3)59)58-40(66)30(11-8-20-51-44(49)50)54-37(63)28(47)9-4-6-18-45/h12-15,24-25,28-33,36,59-60H,4-11,16-23,45-47H2,1-3H3,(H2,48,61)(H,52,68)(H,53,62)(H,54,63)(H,55,67)(H,56,65)(H,57,64)(H,58,66)(H,69,70)(H4,49,50,51)/t25-,28+,29+,30+,31+,32+,33+,36+/m1/s1
InChIKey
KCDSBTNBXZKKLC-MVPDBZEZSA-N
Chemical Structure
2D Structure
2D structure of (2S)-2-[[(2S)-6-Amino-2-[[(2S)-2-[[(2S)-5-amino-2-[[2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-hydroxybutanoyl]amino]acetyl]amino]-5-oxopentanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]-4-methylpentanoic acid
CAS: 152051-61-1
CID: 10129746
Formula: C44H76N14O12
MW: 993.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight993.2
XLogP3-6.1
Hydrogen Bond Donor Count16
Hydrogen Bond Acceptor Count16
Rotatable Bond Count35
Exact Mass992.57671391
Monoisotopic Mass992.57671391
Topological Polar Surface Area467 Ų
Heavy Atom Count70
Formal Charge0
Complexity1730
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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