Chem
J-GLOBAL ID:200907016198275704
Nikkaji number:J358.671E
Chlamydocin
クラミドシン
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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:
C28 H38 N4 O6
Molecular formula furigana:
C28-H38-N4-O6
Molecular weight:
526.634
InChI:
InChI=1S/C28H38N4O6/c1-28(2)27(37)30-20(16-18-10-5-3-6-11-18)26(36)32-15-9-13-21(32)25(35)29-19(24(34)31-28)12-7-4-8-14-22(33)23-17-38-23/h3,5-6,10-11,19-21,23H,4,7-9,12-17H2,1-2H3,(H,29,35)(H,30,37)(H,31,34)/t19-,20-,21+,23-/m0/s1
InChI key:
SGYJGGKDGBXCNY-QXUYBEEESA-N
SMILES:
CC1(C)NC(=O)[C@H](CCCCCC(=O)[C@@H]2CO2)NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC1=O
Systematic name (3):
2-メチルシクロ[Ala-L-Phe-D-Pro-6-[(S)-2-オキソ-2-オキシラニルエチル]-L-Nle-]
(3S,9S,14aR)-9-ベンジル-6,6-ジメチル-3-{6-[(2S)-オキシラン-2-イル]-6-オキソヘキシル}-テトラデカヒドロピロロ[1,2-a]1,4,7,10-テトラアザシクロドデカン-1,4,7,10-テトラオン
(3S,9S,14aR)-9-benzyl-6,6-dimethyl-3-{6-[(2S)-oxiran-2-yl]-6-oxohexyl}-tetradecahydropyrrolo[1,2-a]1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrone
Other name (6):
CAS registry number:
53342-16-8
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