Chem
J-GLOBAL ID:200907029934328009
Nikkaji number:J1.938.635J
Hederacine B
ヘデラシンB
Download MOL file
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:
C16 H24 N2 O2
Molecular formula furigana:
C16-H24-N2-O2
Molecular weight:
276.380
InChI:
InChI=1S/C16H24N2O2/c1-9-10-7-12-14(2)6-5-11(17)15(14,3)8-16(10,18(12)4)20-13(9)19/h11-12H,5-8,17H2,1-4H3/t11-,12+,14-,15-,16-/m1/s1
InChI key:
BVSWLVMJRQRUFY-UDUPFKKZSA-N
SMILES:
CN1[C@H]2CC3=C(C)C(=O)O[C@@]13C[C@]1(C)[C@H](N)CC[C@]21C
Systematic name (3):
(5S)-3,5aα,8aα,10-テトラメチル-5α,9aα-エピミノ-8β-アミノ-2,4,5,5a,6,7,8,8a,9,9a-デカヒドロアズレノ[5,6-b]フラン-2-オン
(1R,3S,4R,7S,8S)-4-アミノ-3,7,11,14-テトラメチル-13-オキサ-14-アザテトラシクロ[6.5.1.01,10 .03,7 ]テトラデカ-10-エン-12-オン
(1R,3S,4R,7S,8S)-4-amino-3,7,11,14-tetramethyl-13-oxa-14-azatetracyclo[6.5.1.01,10 .03,7 ]tetradec-10-en-12-one
Other name (3):
(5S)-3,5aα,8aα,10-Tetramethyl-5α,9aα-epimino-8β-amino-2,4,5,5a,6,7,8,8a,9,9a-decahydroazuleno[5,6-b]furan-2-one
ヘデラシンB
Hederacine B
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