16880-35-6 Purity
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Specification
The molecular formula of Boc-PNA-G(Z)-OH is C24H29N7O8.
Some synonyms of Boc-PNA-G(Z)-OH are Boc-PNA-G(Z)-OH, 169287-77-8, and 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl-[2-[6-oxo-2-(phenylmethoxycarbonylamino)-3H-purin-9-yl]acetyl]amino]acetic acid.
The molecular weight of Boc-PNA-G(Z)-OH is 543.5 g/mol.
Boc-PNA-G(Z)-OH was created on 2019-01-15 and modified on 2023-12-30.
The IUPAC name of Boc-PNA-G(Z)-OH is 2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl-[2-[6-oxo-2-(phenylmethoxycarbonylamino)-1H-purin-9-yl]acetyl]amino]acetic acid.
The InChI of Boc-PNA-G(Z)-OH is InChI=1S/C24H29N7O8/c1-24(2,3)39-22(36)25-9-10-30(12-17(33)34)16(32)11-31-14-26-18-19(31)27-21(28-20(18)35)29-23(37)38-13-15-7-5-4-6-8-15/h4-8,14H,9-13H2,1-3H3,(H,25,36)(H,33,34)(H2,27,28,29,35,37).
The InChIKey of Boc-PNA-G(Z)-OH is QPFRXGPXBKQVPU-UHFFFAOYSA-N.
The Canonical SMILES of Boc-PNA-G(Z)-OH is CC(C)(C)OC(=O)NCCN(CC(=O)O)C(=O)CN1C=NC2=C1N=C(NC2=O)NC(=O)OCC3=CC=CC=C3.
The XLogP3-AA value of Boc-PNA-G(Z)-OH is 0.9.
Boc-PNA-G(Z)-OH has 4 hydrogen bond donor count and 10 hydrogen bond acceptor count.