Chem
J-GLOBAL ID：200907050246089792
Nikkaji number：J1.632.525B
Peptide T1(Acm)
ペプチドT1(Acm)
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
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
Molecular formula： C33H56N12O13S3
Molecular formula furigana： C33-H56-N12-O13-S3
Molecular weight： 925.060
InChI：
InChI=1S/C33H56N12O13S3/c1-17(46)40-16-61-15-23(45-27(51)12-36-30(55)20(41-18(2)47)5-3-4-8-34)33(58)39-11-26(50)44-22(14-60)32(57)38-10-25(49)43-21(13-59)31(56)37-9-24(48)42-19(29(35)54)6-7-28(52)53/h19-23,59-60H,3-16,34H2,1-2H3,(H2,35,54)(H,36,55)(H,37,56)(H,38,57)(H,39,58)(H,40,46)(H,41,47)(H,42,48)(H,43,49)(H,44,50)(H,45,51)(H,52,53)/t19-,20-,21-,22-,23-/m0/s1
InChI key：
GMWWLKJUKGWRKX-VUBDRERZSA-N
SMILES：
CC(=O)NCSC[C@H](NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)C)C(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CS)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)N
Systematic name (3)：
- Ac-L-Lys-Gly-S-Acm-L-Cys-Gly-L-Cys-Gly-L-Cys-Gly-L-Glu-NH2
- (4S)-4-{2-[(2R)-2-{2-[(2R)-2-{2-[(2R)-2-{2-[(2S)-6-アミノ-2-アセトアミドヘキサンアミド]アセトアミド}-3-[(アセトアミドメチル)スルファニル]プロパンアミド]アセトアミド}-3-スルファニルプロパンアミド]アセトアミド}-3-スルファニルプロパンアミド]アセトアミド}-4-カルバモイルブタン酸
- (4S)-4-{2-[(2R)-2-{2-[(2R)-2-{2-[(2R)-2-{2-[(2S)-6-amino-2-acetamidohexanamido]acetamido}-3-[(acetamidomethyl)sulfanyl]propanamido]acetamido}-3-sulfanylpropanamido]acetamido}-3-sulfanylpropanamido]acetamido}-4-carbamoylbutanoic acid
- ペプチドT1(Acm)
- Peptide T1(Acm)
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