Chem
J-GLOBAL ID:200907024211262911
Nikkaji number:J2.370.624E
1,19-Dioxo-2-ethyl-3,7,13,18-tetramethyl-17-vinyl-21,22-ethano-1,19,21,24-tetrahydro-22H-biline-8,12-dipropionic acid
1,19-ジオキソ-2-エチル-3,7,13,18-テトラメチル-17-ビニル-21,22-エタノ-1,19,21,24-テトラヒドロ-22H-ビリン-8,12-ジプロピオン酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C35 H38 N4 O6
Molecular formula furigana:
C35-H38-N4-O6
Molecular weight:
610.711
InChI:
InChI=1S/C35H38N4O6/c1-7-22-21(6)34(44)37-27(22)15-26-18(3)24(9-11-32(40)41)28(36-26)16-31-25(10-12-33(42)43)20(5)29-17-30-19(4)23(8-2)35(45)39(30)14-13-38(29)31/h7,15-17H,1,8-14H2,2-6H3,(H,37,44)(H,40,41)(H,42,43)
InChI key:
SHSOJILXHYIIFJ-UHFFFAOYSA-N
SMILES:
CCC1=C(C)C2=Cc3c(C)c(CCC(=O)O)c(C=C4N=C(C=C5NC(=O)C(=C5C=C)C)C(=C4CCC(=O)O)C)n3CCN2C1=O
Systematic name (1):
1,19-ジオキソ-2-エチル-3,7,13,18-テトラメチル-17-ビニル-21,22-エタノ-1,19,21,24-テトラヒドロ-22H-ビリン-8,12-ジプロピオン酸
Other name (1):
1,19-Dioxo-2-ethyl-3,7,13,18-tetramethyl-17-vinyl-21,22-ethano-1,19,21,24-tetrahydro-22H-biline-8,12-dipropionic acid
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