Difference between revisions of "RXN1F-168"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=ADP-D-Ribosyl-Acceptors ADP-D-Ribosyl-Acceptors] == * common name: ** an ADP-D-ribosyl acceptor...") |
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREGNENOLONE PREGNENOLONE] == * smiles: ** CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC...") |
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| Line 1: | Line 1: | ||
[[Category:Metabolite]] | [[Category:Metabolite]] | ||
| − | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object= | + | == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=PREGNENOLONE PREGNENOLONE] == |
| + | * smiles: | ||
| + | ** CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34)))) | ||
| + | * inchi key: | ||
| + | ** InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N | ||
* common name: | * common name: | ||
| − | ** | + | ** pregnenolone |
| + | * molecular weight: | ||
| + | ** 316.483 | ||
* Synonym(s): | * Synonym(s): | ||
| + | ** 1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone | ||
| + | ** 5-pregnen-3-β-ol-20-one | ||
| + | ** 3-β-hydroxypregn-5-en-20-one | ||
| + | ** 3beta-hydroxypregn-5-en-20-one | ||
== Reaction(s) known to consume the compound == | == Reaction(s) known to consume the compound == | ||
| + | * [[RXN66-353]] | ||
== Reaction(s) known to produce the compound == | == Reaction(s) known to produce the compound == | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
| − | |||
== External links == | == External links == | ||
| − | {{#set: common name= | + | * DRUGBANK : DB02789 |
| − | {{#set: consumed | + | * CAS : 145-13-1 |
| + | * Wikipedia : Pregnenolone | ||
| + | * LIPID_MAPS : LMST02030088 | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=8955 8955] | ||
| + | * HMDB : HMDB00253 | ||
| + | * LIGAND-CPD: | ||
| + | ** [http://www.genome.jp/dbget-bin/www_bget?C01953 C01953] | ||
| + | * CHEMSPIDER: | ||
| + | ** [http://www.chemspider.com/Chemical-Structure.8611.html 8611] | ||
| + | * CHEBI: | ||
| + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16581 16581] | ||
| + | * METABOLIGHTS : MTBLC16581 | ||
| + | {{#set: smiles=CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))}} | ||
| + | {{#set: inchi key=InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N}} | ||
| + | {{#set: common name=pregnenolone}} | ||
| + | {{#set: molecular weight=316.483 }} | ||
| + | {{#set: common name=1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone|5-pregnen-3-β-ol-20-one|3-β-hydroxypregn-5-en-20-one|3beta-hydroxypregn-5-en-20-one}} | ||
| + | {{#set: consumed by=RXN66-353}} | ||
Revision as of 16:01, 10 January 2018
Contents
Metabolite PREGNENOLONE
- smiles:
- CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))
- inchi key:
- InChIKey=ORNBQBCIOKFOEO-QGVNFLHTSA-N
- common name:
- pregnenolone
- molecular weight:
- 316.483
- Synonym(s):
- 1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone
- 5-pregnen-3-β-ol-20-one
- 3-β-hydroxypregn-5-en-20-one
- 3beta-hydroxypregn-5-en-20-one
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
- DRUGBANK : DB02789
- CAS : 145-13-1
- Wikipedia : Pregnenolone
- LIPID_MAPS : LMST02030088
- PUBCHEM:
- HMDB : HMDB00253
- LIGAND-CPD:
- CHEMSPIDER:
- CHEBI:
- METABOLIGHTS : MTBLC16581
"CC(=O)[CH]3(CC[CH]4([CH]2(CC=C1(CC(O)CCC(C)1[CH]2CCC(C)34))))" cannot be used as a page name in this wiki.
"1-[(3-hydroxy-10,13-dimethyl-2,3,4,7,8,9,10,11,12,13,14,15,16, 17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)]ethanone" cannot be used as a page name in this wiki.
