Primary Record
Val-Cit-PAB-MMAE
- In stock
- 1,845 g
- Purity
- 99.8 %
- CAS
- 644981-35-1
Compound Identifiers & Properties
- CAS
- 644981-35-1
- PubChem CID
- 123456969
- SMILES
- CCC(C)C(C(CC(=O)N1CCCC1C(C(C)C(=O)NC(C)C(C2=CC=CC=C2)O)OC)OC)N(C)C(=O)C(C(C)C)NC(=O)C(C(C)C)N(C)C(=O)OCC3=CC=C(C=C3)NC(=O)C(CCCNC(=O)N)NC(=O)C(C(C)C)N
- Canonical SMILES
- CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(C)C(O)c1ccccc1)OC)N(C)C(=O)C(NC(=O)C(C(C)C)N(C)C(=O)OCc1ccc(NC(=O)C(CCCNC(N)=O)NC(=O)C(N)C(C)C)cc1)C(C)C
Names & Synonyms
- Val-Cit-PAB-MMAE
- Val-Cit-PAB-MMAE?
- SCHEMBL25170198
- C58H94N10O12
- 644981-35-1
- [4-[[2-[(2-amino-3-methyl-butanoyl)amino]-5-ureido-pentanoyl]amino]phenyl]methyl N-[1-[[1-[[4-[2-[3-[(2-hydroxy-1-methyl-2-phenyl-ethyl)amino]-1-methoxy-2-methyl-3-oxo-propyl]pyrrolidin-1-yl]-2-methoxy-4-oxo-1-sec-butyl-butyl]-methyl-carbamoyl]-2-methyl-propyl]carbamoyl]-2-methyl-propyl]-N-methyl-carbamate
- [4-[[2-[(2-amino-3-methylbutanoyl)amino]-5-(carbamoylamino)pentanoyl]amino]phenyl]methyl N-[1-[[1-[[(3R,4S)-1-[(2S)-2-[(1R,2R)-3-[[(1S)-1-hydroxy-1-phenylpropan-2-yl]amino]-1-methoxy-2-methyl-3-oxopropyl]pyrrolidin-1-yl]-3-methoxy-5-methyl-1-oxoheptan-4-yl]-methylamino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-N-methylcarbamate
- {4-[2-(2-amino-3-methylbutanamido)-5-(carbamoylamino)pentanamido]phenyl}methyl N-{1-[(1-{[1-(2-{2-[(1-hydroxy-1-phenylpropan-2-yl)carbamoyl]-1-methoxy-2-methylethyl}pyrrolidin-1-yl)-3-methoxy-5-methyl-1-oxoheptan-4-yl](methyl)carbamoyl}-2-methylpropyl)carbamoyl]-2-methylpropyl}-N-methylcarbamate