CAS 139893-43-9 | 1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)- | CAS Number 139893-43-9

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139893-43-9 | 1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)-

CAS No: 139893-43-9 Catalog No: AG001BS5 MDL No:MFCD07773041

Product Description

Catalog Number:

AG001BS5

Chemical Name:

1-Naphthaleneheptanoic acid, 8-(2,2-dimethyl-1-oxobutoxy)-1,2,6,7,8,8a-hexahydro-β,δ-dihydroxy-2,6-dimethyl-, ammonium salt (1:1), (βR,δR,1S,2S,6R,8S,8aR)-

CAS Number:

139893-43-9

Molecular Formula:

C25H43NO6

Molecular Weight:

453.6120

MDL Number:

MFCD07773041

IUPAC Name:

(3R,5R)-7-[(1S,2S,6R,8S,8aR)-8-(2,2-dimethylbutanoyloxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid;azane

InChI:

InChI=1S/C25H40O6.H3N/c1-6-25(4,5)24(30)31-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-18(26)13-19(27)14-22(28)29;/h7-8,11,15-16,18-21,23,26-27H,6,9-10,12-14H2,1-5H3,(H,28,29);1H3/t15-,16-,18+,19+,20-,21-,23-;/m0./s1

InChI Key:

FFPDWNBTEIXJJF-OKDJMAGBSA-N

SMILES:

CCC(C(=O)O[C@@H]1C[C@H](C)C=C2[C@@H]1[C@H](CC[C@H](C[C@@H](CC(=O)O)[O-])O)[C@@H](C=C2)C)(C)C.[NH4+]

EC Number:

604-165-5