Pluramycin A
基本情報
- CAS
11016-27-6- 標準SMILES
C/C=C/C1OC1(C)c1cc(=O)c2c(C)cc3c(c2o1)C(=O)c1c(O)c(C2CC(C)(N(C)C)C(OC(C)=O)C(C)O2)cc(C2CC(N(C)C)C(O)C(C)O2)c1C3=O- InChIKey
BQCHGWYGWQEMTJ-OUKQBFOZSA-N- 分子式
- C43H52N2O11
- 平均分子量
- 772.9 g/mol
- 単同位体質量
- 772.35711048
概要
pluramycin A has been reported in Streptomyces pluricolorescens and Streptomyces rubiginosohelvolus with data available.
名称と識別子
- 優先名称
- Pluramycin A
- IUPAC
- [4-(dimethylamino)-6-[8-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-11-hydroxy-5-methyl-2-[2-methyl-3-[(E)-prop-1-enyl]oxiran-2-yl]-4,7,12-trioxonaphtho[2,3-h]chromen-10-yl]-2,4-dimethyloxan-3-yl] acetate
名称と別名
Pluramycin A[4-(dimethylamino)-6-[8-[4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl]-11-hydroxy-5-methyl-2-[2-methyl-3-[(E)-prop-1-enyl]oxiran-2-yl]-4,7,12-trioxonaphtho[2,3-h]chromen-10-yl]-2,4-dimethyloxan-3-yl] acetate(4-(dimethylamino)-6-(8-(4-(dimethylamino)-5-hydroxy-6-methyloxan-2-yl)-11-hydroxy-5-methyl-2-(2-methyl-3-((E)-prop-1-enyl)oxiran-2-yl)-4,7,12-trioxonaphtho(2,3-h)chromen-10-yl)-2,4-dimethyloxan-3-yl) acetateRefChem:1096467Pluramycin11016-27-6NSC 21205BRN 1615057SCHEMBL29386293DTXSID00102833410-(4-O-Acetyl-2,3,6-trideoxy-3-(dimethylamino)-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-11-hydroxy-5-methyl-2-(2-methyl-3-(1-propenyl)oxir anyl)-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl)-4H-anthra(1,2-b)pyran-4,7,12-trione4H-Anthra(1,2-b)pyran-4,7,12-trione, 10-(4-O-acetyl-2,3,6-trideoxy-3-(dimethylamino)-3-C-methyl-alpha-L-lyxo-hexopyranosyl)-11-hydroxy-5-methyl-2-(2-methyl-3-(1-propenyl)oxiranyl)-8-(2,3,6-trideoxy-3-(dimethylamino)-beta-D-arabino-hexopyranosyl)-
名称をさらに表示
Q15425256
物性
構造計算による物性
- XLogP
- 3.8
- 極性表面積
- 165 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 13
- 回転可能結合数
- 8
- 重原子数
- 56
- 形式電荷
- 0
- 複雑度
- 1,650
関連反応
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