Drug Information
| Drug General Information | |||||
|---|---|---|---|---|---|
| Drug ID |
D08ZHT
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| Former ID |
DNC000547
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| Drug Name |
Diazaborines
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| Drug Type |
Small molecular drug
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| Indication | Discovery agent | Investigative | [535276] | ||
| Structure |
|
Download2D MOL |
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| Formula |
C59H118N30O19
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| Canonical SMILES |
C1C(C(C(C(C1NC(=O)C(CCCN=C(N)N)N)OC2C(C(C(C(O2)CNC(=O)C<br />(CCCN=C(N)N)N)O)O)NC(=O)C(CCCN=C(N)N)N)OC3C(C(C(O3)CO)O<br />C4C(C(C(C(O4)CNC(=O)C(CCCN=C(N)N)N)O)O)NC(=O)C(CCCN=C(N<br />)N)N)O)O)NC(=O)C(CCCN=C(N)N)N
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| InChI |
1S/C59H118N30O19/c60-23(7-1-13-78-54(66)67)45(97)84-20-31-37(92)39(94)34(88-49(101)27(64)11-5-17-82-58(74)75)51(103-31)106-42-30(87-48(100)26(63)10-4-16-81-57(72)73)19-29(86-47(99)25(62)9-3-15-80-56(70)71)36(91)44(42)108-53-41(96)43(33(22-90)105-53)107-52-35(89-50(102)28(65)12-6-18-83-59(76)77)40(95)38(93)32(104-52)21-85-46(98)24(61)8-2-14-79-55(68)69/h23-44,51-53,90-96H,1-22,60-65H2,(H,84,97)(H,85,98)(H,86,99)(H,87,100)(H,88,101)(H,89,102)(H4,66,67,78)(H4,68,69,79)(H4,70,71,80)(H4,72,73,81)(H4,74,75,82)(H4,76,77,83)/t23-,24-,25-,26-,27-,28-,29+,30-,31+,32-,33+,34+,35+,36-,37+,38+,39+,40+,41+,42+,43+,44+,51+,52?,53-/m0/s1
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| InChIKey |
KBPMSEXASFSGEI-WRBBICKQSA-N
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| PubChem Compound ID | |||||
| PubChem Substance ID | |||||
| Target and Pathway | |||||
| Target(s) | Enoyl-[acyl-carrier-protein] reductase [NADH] 2 | Target Info | Inhibitor | [535276] | |
| Enoyl-[acyl-carrier-protein] reductase [NADH] 1 | Target Info | Inhibitor | [535276] | ||
| Enoyl-ACP reductase | Target Info | Inhibitor | [535276] | ||
| References | |||||
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