[(2S,3S,4R,6R)-6-[(2R,3S,4R,5R,6R)-6-[[(2R,4E,6E,9R,11R,12S,13R,14R)-14-acetyloxy-13-methoxy-2,9-dimethyl-8,16-dioxo-11-(2-oxoethyl)-1-oxacyclohexadeca-4,6-dien-12-yl]oxy]-4-dimethylamino-5-hydroxy-2-methyl-oxan-3-yl]oxy-4-hydroxy-2,4-dimethyl-oxan-3-yl] 3-methylbutanoate hydrochloride
Molecular Formula:
C42H68ClNO15
InChI: InChI=1/C42H67NO15.ClH/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45;/h12-14,16,18,23-27,29,31,34-41,49-50H,15,17,19-22H2,1-11H3;1H/b13-12+,16-14+;/t24-,25-,26-,27+,29+,31-,34+,35-,36-,37-,38+,39+,40+,41+,42-;/m1./s1
InChIKey: InChIKey=IJCYICVVWRRLKC-NFOLVDNTBJ
SMILES: CC1CC=CC=CC(=O)C(CC(C(C(C(CC(=O)O1)OC(=O)C)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O)C.Cl
Names:
[(2S,3S,4R,6R)-6-[(2R,3S,4R,5R,6R)-6-[[(2R,4E,6E,9R,11R,12S,13R,14R)-14-acetyloxy-13-methoxy-2,9-dimethyl-8,16-dioxo-11-(2-oxoethyl)-1-oxacyclohexadeca-4,6-dien-12-yl]oxy]-4-dimethylamino-5-hydroxy-2-methyl-oxan-3-yl]oxy-4-hydroxy-2,4-dimethyl-oxan-3-yl] 3-methylbutanoate hydrochloride
Registries:
PubChem CID 6433777
PubChem ID 11620625
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