penicillin G
Chemical Formula:
C16H17N2O4S
Molecular Weight:
333.381 Daltons
Monoisotopic Mass:
334.0987277666 Daltons
SMILES:
CC3(C)(S[CH]2(N(C(=O)C(NC(=O)CC1(C=CC=CC=1))2)C(C(=O)[O-])3))
InChI:
1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/p-1/t11-,12+,14-/m1/s1
InChIKey:
Synonyms
- benzylpenicillin
Databases
MetaCyc:
PENICILLIN-G
RefMet:
Penicillin G
MetaboLights:
MTBLC51354
HMDB:
HMDB15186
ChemSpider:
555781
KEGG:
C05551
ChEBI:
51354
Seed:
cpd03292
MetaNetX:
MNXM1812