Chem
J-GLOBAL ID：200907087311974775   Nikkaji number：J1.292.439I

(2S)-1-[(9H-Fluorene-9-yl)methoxycarbonyl]-4α-[3-[(2,2,5,7,8-pentamethylchroman-6-yl)sulfonyl]guanidino]pyrrolidine-2α-carboxylic acid

(2S)-1-[(9H-フルオレン-9-イル)メトキシカルボニル]-4α-[3-[(2,2,5,7,8-ペンタメチルクロマン-6-イル)スルホニル]グアニジノ]ピロリジン-2α-カルボン酸
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： C35H40N4O7S
Molecular formula furigana： C35-H40-N4-O7-S
Molecular weight： 660.790
InChI： InChI=1S/C35H40N4O7S/c1-19-20(2)31(21(3)23-14-15-35(4,5)46-30(19)23)47(43,44)38-33(36)37-22-16-29(32(40)41)39(17-22)34(42)45-18-28-26-12-8-6-10-24(26)25-11-7-9-13-27(25)28/h6-13,22,28-29H,14-18H2,1-5H3,(H,40,41)(H3,36,37,38)/t22-,29-/m0/s1
InChI key： YIBHRDWQYVEQRQ-ZTOMLWHTSA-N
SMILES： Cc1c(C)c(c(C)c2CCC(C)(C)Oc12)S(=O)(=O)NC(=N)N[C@H]1C[C@H](N(C1)C(=O)OCC1c2ccccc2c2ccccc12)C(=O)O
Systematic name  (3)：
  • (2S)-1-[(9H-フルオレン-9-イル)メトキシカルボニル]-4α-[3-[(2,2,5,7,8-ペンタメチルクロマン-6-イル)スルホニル]グアニジノ]ピロリジン-2α-カルボン酸
  • (2S,4S)-1-{[(9H-フルオレン-9-イル)メトキシ]カルボニル}-4-{N'-[(2,2,5,7,8-ペンタメチル-3,4-ジヒドロ-2H-1-ベンゾピラン-6-イル)スルホニル]カルバムイミドアミド}ピロリジン-2-カルボン酸
  • (2S,4S)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-{N'-[(2,2,5,7,8-pentamethyl-3,4-dihydro-2H-1-benzopyran-6-yl)sulfonyl]carbamimidamido}pyrrolidine-2-carboxylic acid
Other name (1)：
  • (2S)-1-[(9H-Fluorene-9-yl)methoxycarbonyl]-4α-[3-[(2,2,5,7,8-pentamethylchroman-6-yl)sulfonyl]guanidino]pyrrolidine-2α-carboxylic acid
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