ertapenem dimer form D impurity
group of stereoisomers
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ertapenem dimer form D impurity
Summary
ertapenem dimer form D impurity is a group of stereoisomers[1].
Key Facts
- ertapenem dimer form D impurity's instance of is recorded as group of stereoisomers[2].
- ertapenem dimer form D impurity's CAS Registry Number is recorded as 1199797-41-5[3].
- ertapenem dimer form D impurity's canonical SMILES is recorded as CC(O)C(C(=O)N1CC(SC2=C(C(=O)O)N3C(=O)C(C(C)O)C3C2C)CC1C(O)=Nc1cccc(C(=O)O)c1)C1N=C(C(=O)O)C(SC2CNC(C(O)=Nc3cccc(C(=O)O)c3)C2)C1C[4].
- ertapenem dimer form D impurity's InChI is recorded as InChI=1S/C44H50N6O14S2/c1-17-31(48-32(43(61)62)35(17)65-25-13-27(45-15-25)37(53)46-23-9-5-7-21(11-23)41(57)58)29(19(3)51)39(55)49-16-26(14-28(49)38(54)47-24-10-6-8-22(12-24)42(59)60)66-36-18(2)33-30(20(4)52)40(56)50(33)34(36)44(63)64/h5-12,17-20,25-31,33,35,45,51-52H,13-16H2,1-4H3,(H,46,53)(H,47,54)(H,57,58)(H,59,60)(H,61,62)(H,63,64)/t17-,18-,19-,20-,25+,26+,27+,28+,29-,30-,31-,33-,35?/m1/s1[5].
- ertapenem dimer form D impurity's InChIKey is recorded as KFMXBHFRIBLSQJ-KXGFPTOCSA-N[6].
- ertapenem dimer form D impurity's chemical formula is recorded as C₄₄H₅₀N₆O₁₄S₂[7].
- ertapenem dimer form D impurity's subclass of is recorded as chemical compound[8].
- ertapenem dimer form D impurity's UNII is recorded as BF98MVL6BQ[9].
- ertapenem dimer form D impurity's PubChem CID is recorded as 1316414[10].
- ertapenem dimer form D impurity's PubChem CID is recorded as 71316414[11].
- ertapenem dimer form D impurity's isomeric SMILES is recorded as CC@@HC@@H[C@@H]1N=C(C(=O)O)C(S[C@@H]2CNC@HC2)[C@@H]1CC@@HC@@H[C@@H]1N=C(C(=O)O)C(S[C@@H]2">[12].
- ertapenem dimer form D impurity's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+950.2826422800001'}[13].
- ertapenem dimer form D impurity's SureChEMBL ID is recorded as 12509127[14].
- ertapenem dimer form D impurity's DSSTox substance ID is recorded as DTXSID10747712[15].
- ertapenem dimer form D impurity's DSSTOX compound identifier is recorded as DTXCID50698456[16].
- ertapenem dimer form D impurity's UniChem compound ID is recorded as 9494308[17].