Chem
J-GLOBAL ID:200907038680877111
Nikkaji number:J1.660.938B
Daphnicyclidin D
ダフニシクリジンD
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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:
C23 H27 NO4
Molecular formula furigana:
C23-H27-N-O4
Molecular weight:
381.472
InChI:
InChI=1S/C23H27NO4/c1-11-9-24-10-12-4-5-16-17-13(6-7-28-16)18(22(26)27-3)19-15(25)8-14(11)21(24)23(12,2)20(17)19/h11-12,14,21H,4-10H2,1-3H3/t11-,12-,14+,21-,23+/m1/s1
InChI key:
OLNYEDPFKSJCGX-LBNQWIPYSA-N
SMILES:
COC(=O)C1=C2CCOC3=C2C2=C1C(=O)C[C@H]1[C@H](C)CN4C[C@@H](CC3)[C@]2(C)[C@@H]14
Systematic name (3):
(2aS,11S)-8-オキソ-10bα,11-ジメチル-1,10β-エタノ-5,6-(エポキシエタノ)-1,2,2aα,3,4,8,9,10,10aα,10b-デカヒドロ-1-アザジシクロペンタ[ef,kl]ヘプタレン-7-カルボン酸メチル
メチル (4S,5S,8R,9S,10S)-5,9-ジメチル-2-オキソ-14-オキサ-7-アザヘキサシクロ[15.2.1.17,10 .04,8 .09,19 .013,18 ]ヘンイコサ-1(19),13(18),17(20)-トリエン-20-カルボキシラート
methyl (4S,5S,8R,9S,10S)-5,9-dimethyl-2-oxo-14-oxa-7-azahexacyclo[15.2.1.17,10 .04,8 .09,19 .013,18 ]henicosa-1(19),13(18),17(20)-triene-20-carboxylate
Other name (4):
(2aS,11S)-8-Oxo-10bα,11-dimethyl-1,10β-ethano-5,6-(epoxyethano)-1,2,2aα,3,4,8,9,10,10aα,10b-decahydro-1-azadicyclopenta[ef,kl]heptalene-7-carboxylic acid methyl ester
ダフニシクリジンD
Daphnicycridin D
Daphnicyclidin D
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