Pcnotaxime group
(2R)-2-[(R)-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-carboxymethyl]-5-methylidene-2H-1,3-thiazine-4-carboxylic acid
Molecular Identity
Pcnotaxime group
(2R)-2-[(R)-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-carboxymethyl]-5-methylidene-2H-1,3-thiazine-4-carboxylic acid
PubChem CID: 6323466
2D Structure
Properties
C14H15N5O6S2
Molecular Formula
413.40
Molecular Weight
g/mol
413.0464
Exact Mass
Da
0.6
XLogP
Drug-like (Lipinski: < 5)
230
TPSA
May have limited oral absorption
4
H-Bond Donors
12
H-Bond Acceptors
712
Complexity
SMILES
Canonical SMILES
SMILES: CON=C(C1=CSC(=N1)N)C(=O)NC(C2N=C(C(=C)CS2)C(=O)O)C(=O)OIsomeric SMILES
SMILES: CO/N=C(/C1=CSC(=N1)N)\C(=O)N[C@@H]([C@@H]2N=C(C(=C)CS2)C(=O)O)C(=O)OSynonyms(7)
PCNOTAXIME GROUPopenC3'-cleaved-2H-1,3-thiazine-4-carboxylic acidQ27097590(2R)-2-[(R)-{[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino}(carboxy)methyl]-5-methylidene-5,6-dihydro(2r)-2-[(R)-{[(2z)-2-(2-Amino-1,3-Thiazol-4-Yl)-2-(Methoxyimino)acetyl]amino}(Carboxy)methyl]-5-Methylidene-5,6-Dihydro-2h-1,3-Thiazine-4-Carboxylic Acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Pcnotaxime group
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