2-(2,6-Dideoxy-4-O-(2,6-dideoxy-4-O-((2S,5S,6S)-5-(((2R,6S)-5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl)oxy)tetrahydro-6-methyl-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-beta-D-arabino-hexopyranosyl)-1,6,10-trihydroxy-8-methyl-5,12-naphthacenedione
基本情報
- CAS
855779-79-2- 標準SMILES
Cc1cc(O)c2cc3c(c(O)c2c1)C(=O)c1ccc([C@H]2C[C@@H](O)[C@H](O[C@H]4C[C@H](O)[C@H](O[C@H]5CC[C@H](O[C@H]6C=CC(=O)[C@H](C)O6)[C@H](C)O5)[C@H](C)O4)[C@@H](C)O2)c(O)c1C3=O- InChIKey
NWYUSUAHSWSTCK-UHCMZIKDSA-N- 分子式
- C43H48O15
- 平均分子量
- 804.8 g/mol
- 単同位体質量
- 804.29932082
概要
Galtamycin B has been reported in Streptomyces cyaneofuscatus, Micromonospora, and Micromonospora cinerea with data available.
名称と識別子
- 優先名称
- 2-(2,6-Dideoxy-4-O-(2,6-dideoxy-4-O-((2S,5S,6S)-5-(((2R,6S)-5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl)oxy)tetrahydro-6-methyl-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-beta-D-arabino-hexopyranosyl)-1,6,10-trihydroxy-8-methyl-5,12-naphthacenedione
- IUPAC
- 1,6,10-trihydroxy-2-[(2R,4R,5S,6R)-4-hydroxy-5-[(2S,4S,5S,6S)-4-hydroxy-6-methyl-5-[(2S,5S,6S)-6-methyl-5-[[(2R,6S)-6-methyl-5-oxo-2H-pyran-2-yl]oxy]oxan-2-yl]oxyoxan-2-yl]oxy-6-methyloxan-2-yl]-8-methyltetracene-5,12-dione
名称と別名
Galtamycin BNP8M36JU4W855779-79-2DTXSID3010467912-(2,6-Dideoxy-4-O-(2,6-dideoxy-4-O-((2S,5S,6S)-5-(((2R,6S)-5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl)oxy)tetrahydro-6-methyl-2H-pyran-2-yl)-alpha-L-lyxo-hexopyranosyl)-beta-D-arabino-hexopyranosyl)-1,6,10-trihydroxy-8-methyl-5,12-naphthacenedioneRefChem:909098DTXCID401528605UNII-NP8M36JU4W2-(2,6-DIDEOXY-4-O-(2,6-DIDEOXY-4-O-((2S,5S,6S)-5-(((2R,6S)-5,6-DIHYDRO-6-METHYL-5-OXO-2H-PYRAN-2-YL)OXY)TETRAHYDRO-6-METHYL-2H-PYRAN-2-YL)-.ALPHA.-L-LYXO-HEXOPYRANOSYL)-.BETA.-D-ARABINO-HEXOPYRANOSYL)-1,6,10-TRIHYDROXY-8-METHYL-5,12-NAPHTHACENEDIONE5,12-Naphthacenedione, 2-[2,6-dideoxy-4-O-[2,6-dideoxy-4-O-[(2S,5S,6S)-5-[[(2R,6S)-5,6-dihydro-6-methyl-5-oxo-2H-pyran-2-yl]oxy]tetrahydro-6-methyl-2H-pyran-2-yl]-alpha-L-lyxo-hexopyranosyl]-beta-D-arabino-hexopyranosyl]-1,6,10-trihydroxy-8-methyl-
データベース識別子
- CAS
855779-79-2- PubChem CID
- 11764280
- DTXSID
DTXSID301046791
物性
構造計算による物性
- XLogP
- 5.1
- 極性表面積
- 217 Ų
- 水素結合供与体数
- 5
- 水素結合受容体数
- 15
- 回転可能結合数
- 7
- 重原子数
- 58
- 形式電荷
- 0
- 複雑度
- 1,540
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