SP-Chymostatin B

(2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-3-methyl-1-oxo-1-[[(2S)-1-oxo-3-phenylpropan-2-yl]amino]butan-2-yl]amino]-1-oxopentan-2-yl]carbamoylamino]-3-phenylpropanoic acid

CAS: 70857-49-7

Molecular Formula	`C30H41N7O6`
Molecular Weight	595.7 g/mol
LogP	1.7
Topological Polar Surface Area	218.0 A2
Hydrogen Bond Donors	7
Hydrogen Bond Acceptors	7
Rotatable Bonds	17
Exact Mass	595.3118
Heavy Atoms	43
Complexity	943.0

Chemical Identifiers

CAS Number	70857-49-7
SMILES	`CC(C)C(C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC2=CC=CC=C2)C(=O)O`
InChIKey	`SABSBIPNNYDZRS-QORCZRPOSA-N`

📖 Product Overview

SP-Chymostatin B (CAS: 70857-49-7) is a chemical compound with molecular formula C30H41N7O6 and molecular weight 595.7 g/mol. Its IUPAC systematic name is (2S)-2-[[(2S)-5-(diaminomethylideneamino)-1-[[(2S)-3-methyl-1-oxo-1-[[(2S)-1-oxo-3-phenylpropan-2-yl]amino]butan-2-yl]amino]-1-oxopentan-2-yl]carbamoylamino]-3-phenylpropanoic acid. LogP 1.7 Topological Polar Surface Area 218.0 A2 Hydrogen Bond Donors 7 Hydrogen Bond Acceptors 7 Rotatable Bonds 17 Exact Mass 595.3118 Heavy Atoms 43 Complexity 943.0 InChI Key: SABSBIPNNYDZRS-QORCZRPOSA-N. SMILES: CC(C)C(C(=O)NC(CC1=CC=CC=C1)C=O)NC(=O)C(CCCN=C(N)N)NC(=O)NC(CC2=CC=CC=C2)C(=O)O.

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