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9alpha-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetate

Properties

Image

Occurences in reactions

MNX_ID

MNXM118705

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₂₂H₃₂O₅

charge

mass

376.22497

reference

InChIKey

ZYTJBCOGBFUTOP-WQLSENKSSA-N

InChI

InChI=1S/C22H32O5/c1-8-12(4)22(25)27-19-10-16(11(2)3)21-17(13(19)5)9-18(24)20(21)14(6)26-15(7)23/h8,11,14,16-17,19-21H,5,9-10H2,1-4,6-7H3/b12-8-

SMILES

C=C1C(OC(=O)/C(C)=C\C)CC(C(C)C)C2C1CC(=O)C2C(C)OC(C)=O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:174990 chebi:174990	9alpha-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetate [1-(1-acetyloxyethyl)-4-methylidene-2-oxo-7-propan-2-yl-3,3a,5,6,7,7a-hexahydro-1H-inden-5-yl] (Z)-2-methylbut-2-enoate
hmdb:HMDB0040955	9alpha-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetate 1-[1-(Acetyloxy)ethyl]-4-methylidene-2-oxo-7-(propan-2-yl)-octahydro-1H-inden-5-yl (2Z)-2-methylbut-2-enoic acid 1-[1-(acetyloxy)ethyl]-4-methylidene-2-oxo-7-(propan-2-yl)-octahydro-1H-inden-5-yl (2Z)-2-methylbut-2-enoate 1-[1-(acetyloxy)ethyl]-7-isopropyl-4-methylidene-2-oxo-hexahydro-1H-inden-5-yl (2Z)-2-methylbut-2-enoate 9a-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetate 9a-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetic acid 9alpha-(Angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetic acid 9alpha-(angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetate 9alpha-(angeloyloxy)-4S-hydroxy-10(14)-oplopen-3-one 4-acetic acid
hmdb:HMDB40955	secondary/obsolete/fantasy identifier