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Chemical structure of Taltobulin intermediate-4

GC74122

Taltobulin intermediate-4

Also known as ethyl (E,4S)-4-[[(2S)-3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-methylamino]-2,5-dimethylhex-2-enoate

Taltobulin intermediate-4 is an intermediate in the synthesis of Taltobulin

ChemicalCAS187345-37-5MW412.56FormulaC22H40N2O5
CAS number
187345-37-5
Molecular weight
412.56
Formula
C22H40N2O5
Solubility
DMSO ： 100 mg/mL (242·39 mM; Need ultrasonic)
InChIKey
MFZVQAHFZVUOFQ-IDGBWPAGSA-N
Catalogue number
GC74122
Brand
GLPBIO
Computed properties PubChem CID 10938542 · XLogP 4.5 · TPSA 84.9 Ų · H-bond donors 1
XLogP
4.5
TPSA
84.9 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
11
Heavy atoms
29

SMILES CCOC(=O)/C(=C/[C@H](C(C)C)N(C)C(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C)/C

Computed descriptors from PubChem (CID 10938542), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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