Difference between revisions of "CPD-17050"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-17050 CPD-17050] == * smiles: ** C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3) * common name...") |
|||
| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3) | ** C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3) | ||
| − | |||
| − | |||
| − | |||
| − | |||
* molecular weight: | * molecular weight: | ||
** 296.358 | ** 296.358 | ||
| + | * inchi key: | ||
| + | ** InChIKey=POIIJAAGMGNXLO-VXGBXAGGSA-N | ||
| + | * common name: | ||
| + | ** 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-diketopiperazine | ||
* Synonym(s): | * Synonym(s): | ||
** 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-DKP | ** 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-DKP | ||
| Line 21: | Line 21: | ||
** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657891 90657891] | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=90657891 90657891] | ||
{{#set: smiles=C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3)}} | {{#set: smiles=C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3)}} | ||
| − | |||
| − | |||
{{#set: molecular weight=296.358 }} | {{#set: molecular weight=296.358 }} | ||
| + | {{#set: inchi key=InChIKey=POIIJAAGMGNXLO-VXGBXAGGSA-N}} | ||
| + | {{#set: common name=3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-diketopiperazine}} | ||
{{#set: common name=3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-DKP|3-benzyl-3,6 -disulfide-6-(hydroxymethyl)piperazine-2,5-dione}} | {{#set: common name=3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-DKP|3-benzyl-3,6 -disulfide-6-(hydroxymethyl)piperazine-2,5-dione}} | ||
{{#set: produced by=RXN-15684}} | {{#set: produced by=RXN-15684}} | ||
Latest revision as of 11:39, 10 January 2019
Contents
Metabolite CPD-17050
- smiles:
- C(O)C23(SSC(CC1(=CC=CC=C1))(NC(=O)2)C(=O)N3)
- molecular weight:
- 296.358
- inchi key:
- InChIKey=POIIJAAGMGNXLO-VXGBXAGGSA-N
- common name:
- 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-diketopiperazine
- Synonym(s):
- 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)-DKP
- 3-benzyl-3,6 -disulfide-6-(hydroxymethyl)piperazine-2,5-dione
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- PUBCHEM:
