Chem
J-GLOBAL ID:200907078391584892
Nikkaji number:J67.499K
Capreomycin IA
カプレオマイシンIA
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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:
C25 H44 N14 O8
Molecular formula furigana:
C25-H44-N14-O8
Molecular weight:
668.717
InChI:
InChI=1S/C25H44N14O8/c26-4-1-2-11(27)6-17(41)32-8-14-20(43)35-15(9-34-25(30)47)21(44)39-18(13-3-5-31-24(29)38-13)23(46)33-7-12(28)19(42)37-16(10-40)22(45)36-14/h9,11-14,16,18,40H,1-8,10,26-28H2,(H,32,41)(H,33,46)(H,35,43)(H,36,45)(H,37,42)(H,39,44)(H3,29,31,38)(H3,30,34,47)/b15-9-/t11-,12-,13+,14?,16-,18?/m0/s1
InChI key:
JNIIDKODPGHQSS-IKKZSHAISA-N
SMILES:
NCCC[C@H](N)CC(=O)NCC1NC(=O)[C@H](CO)NC(=O)[C@@H](N)CNC(=O)C(NC(=O)/C(=C/NC(=O)N)/NC1=O)[C@H]1CCNC(=N)N1
Systematic name (3):
シクロ[A2 pr*-Ser-N3 -[(3S)-3,6-ジアミノ-1-オキソヘキシル]A2 pr-2-[(Z)-アミノカルボニルアミノメチレン]Gly-2-[(4R)-2-イミノヘキサヒドロピリミジン-4-イル]Gly-]
(3S)-3,6-ジアミノ-N-{[(2S,5S,8Z,11S,15S)-15-アミノ-8-[(カルバモイルアミノ)メチリデン]-2-(ヒドロキシメチル)-11-[(4R)-2-イミノ-1,3-ジアジナン-4-イル]-3,6,9,12,16-ペンタオキソ-1,4,7,10,13-ペンタアザシクロヘキサデカン-5-イル]メチル}ヘキサンアミド
(3S)-3,6-diamino-N-{[(2S,5S,8Z,11S,15S)-15-amino-8-[(carbamoylamino)methylidene]-2-(hydroxymethyl)-11-[(4R)-2-imino-1,3-diazinan-4-yl]-3,6,9,12,16-pentaoxo-1,4,7,10,13-pentaazacyclohexadecan-5-yl]methyl}hexanamide
Other name (7):
CAS registry number:
37280-35-6
Regulation number (1):
Application (1):
peptide antibiotics
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