Mesobiliverdin Iv Alpha
Thuốc Gốc
Small Molecule
CTHH: C33H37N4O6
PTK: 585.6701
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C33H37N4O6
Phân tử khối
585.6701
Monoisotopic mass
585.271309936
IUPAC Name
3-[(2Z)-2-{[4-(2-carboxyethyl)-5-{[(2Z)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-3-methylpyrrol-2-yl]methylidene}-5-{[(2E)-3-ethyl-4-methyl-5-oxo-2,5-dihydro-1H-pyrrol-2-ylidene]methyl}-3-methyl-2H-pyrrol-4-yl]propanoic acid
Traditional IUPAC Name
mesobiliverdin iv α
SMILES
CCC1=C(C)C(=O)N\C1=C\C1=N\C(=C/c2nc(\C=C3/NC(=O)C(C)=C3CC)c(CCC(O)=O)c2C)\C(C)=C1CCC(O)=O
Độ hòa tan
2.39e-02 g/l
logP
0.62
logS
-4.4
pKa (strongest acidic)
3.45
pKa (Strongest Basic)
6.01
PSA
158.05 Å2
Refractivity
167.36 m3·mol-1
Polarizability
64.22 Å3
Rotatable Bond Count
11
H Bond Acceptor Count
8
H Bond Donor Count
4
Physiological Charge
-2
Number of Rings
4
Bioavailability
0
MDDR-Like Rule
true
Tài Liệu Tham Khảo Thêm
drugbank
PubChem Compound
PubChem Substance
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