Difference between revisions of "CPD-293"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-293 CPD-293] == * smiles: ** CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))...") |
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* smiles: | * smiles: | ||
** CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34)))) | ** CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34)))) | ||
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* molecular weight: | * molecular weight: | ||
** 316.483 | ** 316.483 | ||
| + | * inchi key: | ||
| + | ** InChIKey=XMRPGKVKISIQBV-BJMCWZGWSA-N | ||
| + | * common name: | ||
| + | ** 5-α-pregnane-3,20-dione | ||
* Synonym(s): | * Synonym(s): | ||
** 3,20-allopregnanedione | ** 3,20-allopregnanedione | ||
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== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
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* CHEMSPIDER: | * CHEMSPIDER: | ||
** [http://www.chemspider.com/Chemical-Structure.83782.html 83782] | ** [http://www.chemspider.com/Chemical-Structure.83782.html 83782] | ||
| + | * METABOLIGHTS : MTBLC28952 | ||
| + | * REFMET : 5alpha-pregnane-3,20-dione | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=92810 92810] | ||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28952 28952] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=28952 28952] | ||
| − | * | + | * CAS : 566-65-4 |
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C03681 C03681] | ||
| + | * HMDB : HMDB03759 | ||
{{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))))}} | {{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))))}} | ||
| − | |||
| − | |||
{{#set: molecular weight=316.483 }} | {{#set: molecular weight=316.483 }} | ||
| + | {{#set: inchi key=InChIKey=XMRPGKVKISIQBV-BJMCWZGWSA-N}} | ||
| + | {{#set: common name=5-α-pregnane-3,20-dione}} | ||
{{#set: common name=3,20-allopregnanedione|3,20-dioxo-5-α-pregnane|5-α-dihydroprogesterone}} | {{#set: common name=3,20-allopregnanedione|3,20-dioxo-5-α-pregnane|5-α-dihydroprogesterone}} | ||
{{#set: produced by=PROGESTERONE-5-ALPHA-REDUCTASE-RXN}} | {{#set: produced by=PROGESTERONE-5-ALPHA-REDUCTASE-RXN}} | ||
Latest revision as of 13:58, 10 January 2019
Contents
Metabolite CPD-293
- smiles:
- CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))))
- molecular weight:
- 316.483
- inchi key:
- InChIKey=XMRPGKVKISIQBV-BJMCWZGWSA-N
- common name:
- 5-α-pregnane-3,20-dione
- Synonym(s):
- 3,20-allopregnanedione
- 3,20-dioxo-5-α-pregnane
- 5-α-dihydroprogesterone
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- CHEMSPIDER:
- METABOLIGHTS : MTBLC28952
- REFMET : 5alpha-pregnane-3,20-dione
- PUBCHEM:
- CHEBI:
- CAS : 566-65-4
- LIGAND-CPD:
- HMDB : HMDB03759
"CC(=O)[CH]3(CC[CH]4([CH]2(CC[CH]1(CC(=O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.
