INGENOL ,30220-46-3 _Chemical Cloud Database

INGENOL

Basic Information
Product Name：	INGENOL
CAS：	30220-46-3
English Synonyms：	INGENOL ; (1AR,2S,5R,5AR,6S,8AS,9R,10AR)-1A,2,5,5A,6,9,10,10A-OCTAHYDRO-5,5A,6-TRIHYDROXY-4-(HYDROXYMETHYL)-1,1,7,9-TETRAMETHYL-1H-2,8A-METHANOCYCLOPENTA[A]CYCLOPROPA[E]CYCLODECEN-11-ONE ; 1A,2,5,5A,6,9,10,10A-OCTAHYDRO-5,5A,6-TRIHYDROXY4(HYDROXYMETHYL)-1,1,7,9-TETRAMETHYL1H-2,8A-METHANOCYCLOPENTA[A]CYCLOPROPA[E]CYCLODECEN-11 ONE ; 1ALPHA,2,5,5ALPHA,6,9,10,10ALPHA-OCTAHYDRO-5,5ALPHA,6-TRIHYDROXY-4-HYDROXYMETHYL-1,1,7,9,-RETRAMETHYL-1H-2,8ALPHA-M
MDL Number.：	MFCD00056380
H bond acceptor：	5
H bond donor：	4
Smile：	C[C@@H]1C[C@@H]2[C@@H](C2(C)C)C3C=C([C@H]([C@]4(C1(C3=O)C=C([C@@H]4O)C)O)O)CO
InChi：	InChI=1S/C20H28O5/c1-9-7-19-10(2)5-13-14(18(13,3)4)12(17(19)24)6-11(8-21)16(23)20(19,25)15(9)22/h6-7,10,12-16,21-23,25H,5,8H2,1-4H3/t10-,12?,13-,14+,15+,16-,19?,20-/m1/s1
InChiKey：	InChIKey=VEBVPUXQAPLADL-WOVWOYSOSA-N
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