Chem
J-GLOBAL ID:200907021769836737
Nikkaji number:J17.157C
Conchosin B
コンコシンB
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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:
C17 H20 O6
Molecular formula furigana:
C17-H20-O6
Molecular weight:
320.341
InChI:
InChI=1S/C17H20O6/c1-9-12-5-4-11(8-22-10(2)18)17(21)7-6-13(19)16(17,3)14(12)23-15(9)20/h6-7,11-12,14,21H,1,4-5,8H2,2-3H3/t11-,12+,14-,16+,17-/m1/s1
InChI key:
NQPJUMKNIKXOLH-BEANVFONSA-N
SMILES:
CC(=O)OC[C@H]1CC[C@@H]2[C@@H](OC(=O)C2=C)[C@]2(C)C(=O)C=C[C@@]12O
Systematic name (3):
(3aS)-6α-[(アセチルオキシ)メチル]-2,3,3aβ,4,5,6,6a,9,9a,9bβ-デカヒドロ-6aβ-ヒドロキシ-9aα-メチル-3-メチレンアズレノ[4,5-b]フラン-2,9-ジオン
[(3aS,6R,6aR,9aS,9bR)-6a-ヒドロキシ-9a-メチル-3-メチリデン-2,9-ジオキソ-2H,3H,3aH,4H,5H,6H,6aH,9H,9aH,9bH-アズレノ[4,5-b]フラン-6-イル]メチル アセタート
[(3aS,6R,6aR,9aS,9bR)-6a-hydroxy-9a-methyl-3-methylidene-2,9-dioxo-2H,3H,3aH,4H,5H,6H,6aH,9H,9aH,9bH-azuleno[4,5-b]furan-6-yl]methyl acetate
Other name (3):
コンコシンB
Conchosin B
(3aS)-6α-[(Acetyloxy)methyl]-2,3,3aβ,4,5,6,6a,9,9a,9bβ-decahydro-6aβ-hydroxy-9aα-methyl-3-methyleneazuleno[4,5-b]furan-2,9-dione
CAS registry number:
28625-29-8
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