N-Boc-Val-Dil-Dap-Doe | CAS 135383-62-9 | AnyMole

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HIT212666163

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HIT212666163

HIT ID:HIT212666163
Cas No:135383-62-9
常用名:N-Boc-Val-Dil-Dap-Doe
IUPAC:tert-butyl N-[(1S)-1-{[(3R,4S,5S)-3-methoxy-1-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-2-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]carbamoyl}ethyl]pyrrolidin-1-yl]-5-methyl-1-oxoheptan-4-yl](methyl)carbamoyl}-2-methylpropyl]carbamate
IUPAC:tert-butyl N-[(1S)-1-{[(3R,4S,5S)-3-methoxy-1-[(2S)-2-[(1R,2R)-1-methoxy-2-methyl-2-{[(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethyl]carbamoyl}ethyl]pyrrolidin-1-yl]-5-methyl-1-oxoheptan-4-yl](methyl)carbamoyl}-2-methylpropyl]carbamate
InChI key:VHKMRSGIFYHXIF-RMCOTOGESA-N

分子式:C40H63N5O7S
分子量:758.03
氢键供体数 (HBD):2
氢键受体数 (HBA):7
LogP:5.3927217
SMILES:CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)c1nccs1)OC)N(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C
SMILES:CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)c1nccs1)OC)N(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C

N-Boc-Val-Dil-Dap-Doe is used in the synthesis of Dolastatin 10, a potent antimitotic peptide that inhibits tubulin polymerization.

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TargetMolSC
规格
货期
3-6月
纯度
-
待询
1

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