THAPSIGARGIN ,67526-95-8 _Chemical Cloud Database

THAPSIGARGIN

Basic Information
Product Name：	THAPSIGARGIN
CAS：	67526-95-8
English Synonyms：	(3S,3AR,4S,6S,6AR,7S,8S,9BS)-6-(ACETYLOXY)-2,3,3A,4,5,6,6A,7,8,9B-DECAHYDRO-3,3A-DIHYDROXY-3,6,9-TRIMETHYL-8-[ [(2Z)-2-METHYL-1-OXO-2-BUTENYL]OXY]-2-OXO-4-(1-OXOBUTOX Y)AZULENO[4,5-B]FURAN-7-YL OCTANOATE ; TG ; THAPSIGARGIN
MDL Number.：	MFCD00083511
H bond acceptor：	12
H bond donor：	2
Smile：	CCCCCCCC(=O)O[C@H]1[C@H]2C(=C([C@@H]1OC(=O)/C(=C\C)/C)C)[C@H]3[C@]([C@H](C[C@]2(C)OC(=O)C)OC(=O)CCC)([C@](C(=O)O3)(C)O)O
InChi：	InChI=1S/C34H50O12/c1-9-12-13-14-15-17-24(37)43-28-26-25(20(5)27(28)44-30(38)19(4)11-3)29-34(41,33(8,40)31(39)45-29)22(42-23(36)16-10-2)18-32(26,7)46-21(6)35/h11,22,26-29,40-41H,9-10,12-18H2,1-8H3/b19-11-/t22-,26+,27-,28-,29-,32-,33+,34+/m0/s1
InChiKey：	InChIKey=IXFPJGBNCFXKPI-FSIHEZPISA-N
Property
Comments：	ASSAY (TLC)
Specification：	GUARANTEED REAGENT
Safety information
Symbol：	GHS07 GHS08
Signal word：	Danger
Hazard statements：	H315-H319-H334-H335
Precautionary statements：	P261-P305 + P351 + P338-P342 + P311
hazard symbol：	Xn
Risk Code：	R:36/37/38-42
Safe Code：	S:26-36/37/39
WGK Germany：	3

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