Chem
J-GLOBAL ID:200907022926838460
Nikkaji number:J41.467K
Clavamycin B
クラバマイシン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:
C13 H22 N4 O8
Molecular formula furigana:
C13-H22-N4-O8
Molecular weight:
362.339
InChI:
InChI=1S/C13H22N4O8/c14-2-4(18)10(20)9(13(23)24)16-12(22)8(15)11(21)5-3-17-6(19)1-7(17)25-5/h4-5,7-11,18,20-21H,1-3,14-15H2,(H,16,22)(H,23,24)
InChI key:
XBWUFTNBJKUSQL-UHFFFAOYSA-N
SMILES:
NCC(O)C(O)C(NC(=O)C(N)C(O)C1CN2C(CC2=O)O1)C(=O)O
Systematic name (3):
3,4-ジヒドロキシ-2-[3-(7-オキソ-4-オキサ-1-アザビシクロ[3.2.0]ヘプタン-3-イル)-3-ヒドロキシ-2-アミノプロパノイルアミノ]-5-アミノ吉草酸
5-アミノ-2-(2-アミノ-3-ヒドロキシ-3-{7-オキソ-4-オキサ-1-アザビシクロ[3.2.0]ヘプタン-3-イル}プロパンアミド)-3,4-ジヒドロキシペンタン酸
5-amino-2-(2-amino-3-hydroxy-3-{7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl}propanamido)-3,4-dihydroxypentanoic acid
Other name (3):
クラバマイシンB
Clavamycin B
3,4-Dihydroxy-2-[3-(7-oxo-4-oxa-1-azabicyclo[3.2.0]heptan-3-yl)-3-hydroxy-2-aminopropanoylamino]-5-aminovaleric acid
CAS registry number:
103080-36-0
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