Drug Information
Drug General Information | |||||
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Drug ID |
D0D6MO
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Former ID |
DNC005786
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Drug Name |
Pen(Acm)AQFRKEKETFC(Acm)-OH
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Indication | Discovery agent | Investigative | [527770] | ||
Structure |
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Download2D MOL |
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Formula |
C64H98N18O19S2
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Canonical SMILES |
CC1C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O<br />)NC(C(=O)NC(C(=O)NC(C(=O)NC(CSSCC(C(=O)N1)N)C(=O)O)CC2=<br />CC=CC=C2)C(C)O)CCC(=O)O)CCCCN)CCC(=O)O)CCCCN)CCCN=C(N)N<br />)CC3=CC=CC=C3)CCC(=O)N
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InChI |
1S/C64H98N18O19S2/c1-34-52(89)73-42(21-24-48(68)84)58(95)79-45(30-36-14-5-3-6-15-36)60(97)76-41(20-13-29-71-64(69)70)56(93)74-39(18-9-11-27-65)54(91)77-43(22-25-49(85)86)57(94)75-40(19-10-12-28-66)55(92)78-44(23-26-50(87)88)59(96)82-51(35(2)83)62(99)80-46(31-37-16-7-4-8-17-37)61(98)81-47(63(100)101)33-103-102-32-38(67)53(90)72-34/h3-8,14-17,34-35,38-47,51,83H,9-13,18-33,65-67H2,1-2H3,(H2,68,84)(H,72,90)(H,73,89)(H,74,93)(H,75,94)(H,76,97)(H,77,91)(H,78,92)(H,79,95)(H,80,99)(H,81,98)(H,82,96)(H,85,86)(H,87,88)(H,100,101)(H4,69,70,71)/t34-,35-,38-,39-,40-,41+,42+,43+,44+,45-,46+,47+,51-/m1/s1
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InChIKey |
IYWWTDYPQATACO-BDUUBTEFSA-N
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PubChem Compound ID | |||||
Target and Pathway | |||||
Target(s) | T-cell surface antigen CD2 | Target Info | Inhibitor | [527770] | |
KEGG Pathway | Cell adhesion molecules (CAMs) | ||||
Hematopoietic cell lineage | |||||
NetPath Pathway | TCR Signaling Pathway | ||||
IL2 Signaling Pathway | |||||
WikiPathways | Cell surface interactions at the vascular wall | ||||
References |
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