(4R,5S,6S)-3-[[4-[(5S)-2,5-二氢-5-甲基-1H-吡咯-3-基]-2-噻唑基]硫代]-6-[(1R)-1-羟基乙基]-4-甲基-7-氧代-1-氮杂双环[3.2.0]庚-2-烯-2-甲酸

CAS号
426253-04-5
CCD编号
CCD03028088
分子式
C18 H21 N3 O4 S2
分子量
407.513

基本信息

产品名称: (4R,5S,6S)-3-[[4-[(5S)-2,5-二氢-5-甲基-1H-吡咯-3-基]-2-噻唑基]硫代]-6-[(1R)-1-羟基乙基]-4-甲基-7-氧代-1-氮杂双环[3.2.0]庚-2-烯-2-甲酸
CAS: 426253-04-5
中文同义词: (4R,5S,6S)-3-[[4-[(5S)-2,5-二氢-5-甲基-1H-吡咯-3-基]-2-噻唑基]硫代]-6-[(1R)-1-羟基乙基]-4-甲基-7-氧代-1-氮杂双环[3.2.0]庚-2-烯-2-甲酸
英文同义词: (4R,5S,6S)-3-[[4-[(5S)-2,5-DIHYDRO-5-METHYL-1H-PYRROL-3-YL]-2-THIAZOLYL]THIO]-6-[(1R)-1-HYDROXYETHYL]-4-METHYL-7-OXO-1-AZABICYCLO[3.2.0]HEPT-2-ENE-2-CARBOXYLIC ACID ; SMP 601 ; PZ 601
MDL号: MFCD16621103
氢键受体数量: 7
氢键供体数量: 3
Smile: C[C@H]1C=C(CN1)c2csc(n2)SC3=C(N4[C@H]([C@H]3C)[C@H](C4=O)[C@@H](C)O)C(=O)O
InChi: InChI=1S/C18H21N3O4S2/c1-7-4-10(5-19-7)11-6-26-18(20-11)27-15-8(2)13-12(9(3)22)16(23)21(13)14(15)17(24)25/h4,6-9,12-13,19,22H,5H2,1-3H3,(H,24,25)/t7-,8+,9+,12+,13+/m0/s1
InChiKey: InChIKey=XFGOMLIRJYURLQ-GOKYHWASSA-N

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