Chem
J-GLOBAL ID:200907023236476219
Nikkaji number:J1.704.188F
(R)-2-[(N-Isovaleryl-L-Tyr-L-Val-)amino]-3-(4-hydroxyphenyl)propanal
(R)-2-[(N-イソバレリル-L-Tyr-L-Val-)アミノ]-3-(4-ヒドロキシフェニル)プロパナール
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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 H37 N3 O6
Molecular formula furigana:
C28-H37-N3-O6
Molecular weight:
511.619
InChI:
InChI=1S/C28H37N3O6/c1-17(2)13-25(35)30-24(15-20-7-11-23(34)12-8-20)27(36)31-26(18(3)4)28(37)29-21(16-32)14-19-5-9-22(33)10-6-19/h5-12,16-18,21,24,26,33-34H,13-15H2,1-4H3,(H,29,37)(H,30,35)(H,31,36)/t21-,24+,26+/m1/s1
InChI key:
OSMJFYFZOAVCNP-DSBYRVASSA-N
SMILES:
CC(C)CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](Cc1ccc(O)cc1)C=O
Systematic name (3):
(R)-2-[(N-イソバレリル-L-Tyr-L-Val-)アミノ]-3-(4-ヒドロキシフェニル)プロパナール
(2S)-2-[(2S)-3-(4-ヒドロキシフェニル)-2-(3-メチルブタンアミド)プロパンアミド]-N-[(2R)-1-(4-ヒドロキシフェニル)-3-オキソプロパン-2-イル]-3-メチルブタンアミド
(2S)-2-[(2S)-3-(4-hydroxyphenyl)-2-(3-methylbutanamido)propanamido]-N-[(2R)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]-3-methylbutanamide
Other name (1):
(R)-2-[(N-Isovaleryl-L-Tyr-L-Val-)amino]-3-(4-hydroxyphenyl)propanal
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