EPOTHILONE B ,152044-54-7 _Chemical Cloud Database

EPOTHILONE B

Basic Information
Product Name：	EPOTHILONE B
CAS：	152044-54-7
English Synonyms：	EPOTHILONE B ; (-)-EPOTHILONE B ; EPO906 ; (1S,3S,7S,10R,11S,12S,16R)-7,11-DIHYDROXY-8,8,10,12,16-PENTAMETHYL-3-[(1E)-1-METHYL-2-(2-METHYL-4-THIAZOLYL)ETHENYL]-4,17-DIOXABICYCLO[14.1.0]HEPTADECANE-5,9-DIONE ; EPOB ; (1S,3S,7S,10R,11S,12S,16R)-7,11-DIHYDROXY-8,8,10,12,16-PENTAMETHYL-3-((E)-1-(2-METHYLTHIAZOL-4-YL)PROP-1-EN-2-YL)-4,17-DIOXABICYCLO[14.1.0]HEPTADECANE-5,9-DIONE ; PATUPILONE
MDL Number.：	MFCD02101921
H bond acceptor：	7
H bond donor：	2
Smile：	Cc1nc(cs1)/C=C(\C)/[C@@H]2C[C@H]3[C@](O3)(CCC[C@@H]([C@@H]([C@H](C(=O)C([C@H](CC(=O)O2)O)(C)C)C)O)C)C
InChi：	InChI=1S/C27H41NO6S/c1-15-9-8-10-27(7)22(34-27)12-20(16(2)11-19-14-35-18(4)28-19)33-23(30)13-21(29)26(5,6)25(32)17(3)24(15)31/h11,14-15,17,20-22,24,29,31H,8-10,12-13H2,1-7H3/b16-11+/t15-,17+,20-,21-,22-,24-,27+/m0/s1
InChiKey：	InChIKey=QXRSDHAAWVKZLJ-PVYNADRNSA-N
Property
Comments：	SYNTHETIC
Safety information
WGK Germany：	3

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