Chem
J-GLOBAL ID:200907046438509500
Nikkaji number:J852.761J
U-89360
N2 -[(2S,4S,5S)-2-イソプロピル-4-ヒドロキシ-5-アセチルアミノ-6-シクロヘキシルヘキサノイル]-L-Gln-L-Arg-NH2
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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 H52 N8 O6
Molecular formula furigana:
C28-H52-N8-O6
Molecular weight:
596.774
InChI:
InChI=1S/C28H52N8O6/c1-16(2)19(15-23(38)22(34-17(3)37)14-18-8-5-4-6-9-18)26(41)36-21(11-12-24(29)39)27(42)35-20(25(30)40)10-7-13-33-28(31)32/h16,18-23,38H,4-15H2,1-3H3,(H2,29,39)(H2,30,40)(H,34,37)(H,35,42)(H,36,41)(H4,31,32,33)/t19-,20-,21-,22-,23-/m0/s1
InChI key:
XTOQWMLQBSGKOK-VUBDRERZSA-N
SMILES:
CC(C)[C@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)C)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N
Systematic name (3):
N2 -[(2S,4S,5S)-2-イソプロピル-4-ヒドロキシ-5-アセチルアミノ-6-シクロヘキシルヘキサノイル]-L-Gln-L-Arg-NH2
(2S)-N-[(1S)-4-カルバムイミドアミド-1-カルバモイルブチル]-2-[(2S,4S,5S)-6-シクロヘキシル-5-アセトアミド-4-ヒドロキシ-2-(プロパン-2-イル)ヘキサンアミド]ペンタンジアミド
(2S)-N-[(1S)-4-carbamimidamido-1-carbamoylbutyl]-2-[(2S,4S,5S)-6-cyclohexyl-5-acetamido-4-hydroxy-2-(propan-2-yl)hexanamido]pentanediamide
Other name (2):
U-89360
N2 -[(2S,4S,5S)-2-Isopropyl-4-hydroxy-5-acetylamino-6-cyclohexylhexanoyl]-L-Gln-L-Arg-NH2
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