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CHEBI:167318 - (Z)-tomaymycin

ChEBI IDCHEBI:167318
ChEBI Name(Z)-tomaymycin
Stars
ASCII Name(Z)-tomaymycin
DefinitionThe (Z)-isomer of tomaymycin.
Last Modified25 January 2021
SubmitterAdnan
DownloadsMolfile
FormulaC16H20N2O4
Net Charge0
Average Mass304.346
Monoisotopic Mass304.14231
SMILES[H][C@@]12C/C(=C/C)CN1C(=O)c1cc(OC)c(O)cc1N[C@@H]2OC
InChIInChI=1S/C16H20N2O4/c1-4-9-5-12-15(22-3)17-11-7-13(19)14(21-2)6-10(11)16(20)18(12)8-9/h4,6-7,12,15,17,19H,5,8H2,1-3H3/b9-4-/t12-,15+/m0/s1
InChIKeyUQVNRKBFAXNOGA-OHLDGCSVSA-N
Roles Classification
Biological Roles:
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
alkylating agent  Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
(Z)-tomaymycin (CHEBI:167318) is a tomaymycin (CHEBI:157681)
IUPAC Name 
(2Z,11R,11aS)-2-ethylidene-8-hydroxy-7,11-dimethoxy-1,2,3,10,11,11a-hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5-one
Citations