Tan Lab | DSigDB

Gene Set: D4 : CTD - palytoxin

Collection

D4 : CTD

Chemical Name

palytoxin ( From PubChem : PALYTOXIN )

FDA	NPC	WHO	Indian	Australia	China	Traditional Herbal	Clinical Trail
Not	Not	Not	Not	Not	Not	Not	Not

Molecular Weight	Hydrogen Bond Donor Count	Hydrogen Bond Acceptor Count	cLogP	Lipinski Rule
2680.14 g/mol	45	57	-7.1575	False(1/4)

Structure

InChI

InChI=1S/C129H223N3O54/c1-62(29-33-81(143)108(158)103(153)68(7)47-93-111(161)117(167)110(160)91(180-93)36-35-76(138)82(144)51-73-50-74-53-92(178-73)90(177-74)38-37-89-85(147)52-75(61-130)179-89)23-20-28-78(140)105(155)77(139)26-18-13-16-25-70(135)48-94-112(162)118(168)113(163)97(181-94)55-84(146)83(145)54-95-107(157)87(149)57-96(182-95)106(156)80(142)34-32-69(134)31-30-65(4)88(150)60-129(176)125(174)123(173)115(165)99(184-129)49-71(136)24-15-10-9-11-19-40-128-59-64(3)58-127(8,186-128)100(185-128)44-63(2)22-14-12-17-27-79(141)109(159)116(166)120(170)122(172)124-121(171)119(169)114(164)98(183-124)56-86(148)102(152)66(5)45-72(137)46-67(6)104(154)126(175)132-42-39-101(151)131-41-21-43-133/h13,16,18,20,23,25,30-31,35-36,39,42,45,63-65,67-100,102-125,133-150,152-174,176H,1,9-12,14-15,17,19,21-22,24,26-29,32-34,37-38,40-41,43-44,46-61,130H2,2-8H3,(H,131,151)(H,132,175)/b18-13+,23-20-,25-16-,31-30+,36-35-,42-39+,66-45+/t63-,64-,65-,67+,68+,69+,70+,71-,72-,73-,74?,75-,76+,77+,78+,79+,80+,81-,82+,83+,84+,85+,86-,87+,88-,89+,90+,91+,92?,93+,94-,95+,96?,97+,98+,99+,100+,102+,103+,104-,105-,106+,107-,108+,109-,110+,111-,112-,113+,114-,115-,116-,117-,118+,119+,120+,121-,122-,123+,124?,125+,127+,128-,129-/m0/s1

InChIKey

CWODDUGJZSCNGB-HYWCGYIUSA-N

Links

Gene (7 / 11)

⊖ Less

Source	Type	Gene	Other
CTD	increases(expression)	CYBB	C010272
CTD	decreases(reaction)	FOS	C010272
CTD	increases(expression)	FOS	C010272
CTD	decreases(reaction)	MAPK7	C010272
CTD	increases(expression)	MAPK7	C010272
CTD	increases(activity)	MAPK7	C010272
CTD	increases(phosphorylation)	MAPK7	C010272
CTD	increases(expression)	NOS1	C010272
CTD	increases(expression)	NOS2	C010272
CTD	increases(expression)	NOS3	C010272
CTD	increases(expression)	XDH	C010272

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