Chem
J-GLOBAL ID:200907059816645594
Nikkaji number:J599.750J
FPL-67047XX
(4S)-5-[(4-ベンジルフェニル)スルファニル]-4-(7-フェニルヘプタンアミド)ペンタン酸
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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:
C31 H37 NO3 S
Molecular formula furigana:
C31-H37-N-O3-S
Molecular weight:
503.700
InChI:
InChI=1S/C31H37NO3S/c33-30(16-10-2-1-5-11-25-12-6-3-7-13-25)32-28(19-22-31(34)35)24-36-29-20-17-27(18-21-29)23-26-14-8-4-9-15-26/h3-4,6-9,12-15,17-18,20-21,28H,1-2,5,10-11,16,19,22-24H2,(H,32,33)(H,34,35)/t28-/m0/s1
InChI key:
BLFSPSZATDQQMK-NDEPHWFRSA-N
SMILES:
OC(=O)CC[C@@H](CSc1ccc(Cc2ccccc2)cc1)NC(=O)CCCCCCc1ccccc1
Systematic name (4):
(4S)-5-[(4-ベンジルフェニル)チオ]-4-[(7-フェニル-1-オキソヘプチル)アミノ]ペンタン酸
(4S)-4-[(7-フェニル-1-オキソヘプチル)アミノ]-4-[[(4-ベンジルフェニル)チオ]メチル]ブタン酸
(4S)-5-[(4-ベンジルフェニル)スルファニル]-4-(7-フェニルヘプタンアミド)ペンタン酸
(4S)-5-[(4-benzylphenyl)sulfanyl]-4-(7-phenylheptanamido)pentanoic acid
Other name (3):
FPL-67047XX
(4S)-4-[(7-Phenyl-1-oxoheptyl)amino]-4-[[(4-benzylphenyl)thio]methyl]butanoic acid
(4S)-5-[(4-Benzylphenyl)thio]-4-[(7-phenyl-1-oxoheptyl)amino]pentanoic acid
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