Tìm theo
Fusafungine
Thuốc Gốc
Small Molecule
CAS: 1393-87-9
CTHH: C33H57N3O9
PTK: 639.8204
Fusafungine is an antibiotic from Fusarium lateririum, and is used for the treatment of respiratory infections.
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C33H57N3O9
Phân tử khối
639.8204
Monoisotopic mass
639.409480437
InChI
InChI=1/C33H57N3O9/c1-16(2)22-31(40)43-26(20(9)10)29(38)35(14)24(18(5)6)33(42)45-27(21(11)12)30(39)36(15)23(17(3)4)32(41)44-25(19(7)8)28(37)34(22)13/h16-27H,1-15H3/t22-,23-,24-,25?,26?,27?/s2
InChI Key
InChIKey=MIZMDSVSLSIMSC-ZLKDNEIBNA-N
IUPAC Name
(3S,9S,15S)-4,10,16-trimethyl-3,6,9,12,15,18-hexakis(propan-2-yl)-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
Traditional IUPAC Name
(3S,9S,15S)-3,6,9,12,15,18-hexaisopropyl-4,10,16-trimethyl-1,7,13-trioxa-4,10,16-triazacyclooctadecane-2,5,8,11,14,17-hexone
SMILES
[H]C1(OC(=O)[C@]([H])(C(C)C)N(C)C(=O)C([H])(OC(=O)[C@]([H])(C(C)C)N(C)C(=O)C([H])(OC(=O)[C@]([H])(C(C)C)N(C)C1=O)C(C)C)C(C)C)C(C)C
Độ hòa tan
1.84e-02 g/l
logP
4.96
logS
-4.5
pKa (strongest acidic)
18.8
pKa (Strongest Basic)
-5.4
PSA
139.83 Å2
Refractivity
166.6 m3·mol-1
Polarizability
69.27 Å3
Rotatable Bond Count
6
H Bond Acceptor Count
6
H Bond Donor Count
0
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB08965
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