Difference between revisions of "CPD-7061"
From metabolic_network
(Created page with "Category:Reaction == Reaction [http://metacyc.org/META/NEW-IMAGE?object=ACETATE--COA-LIGASE-RXN ACETATE--COA-LIGASE-RXN] == * direction: ** LEFT-TO-RIGHT * common name: **...") |
(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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− | [[Category: | + | [[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(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 | + | == Reaction(s) known to consume the compound == |
− | + | * [[RXN66-353]] | |
− | + | == Reaction(s) known to produce the compound == | |
− | + | == Reaction(s) of unknown directionality == | |
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== External links == | == External links == | ||
− | * | + | * DRUGBANK : DB02789 |
− | * | + | * CAS : 145-13-1 |
− | * | + | * Wikipedia : Pregnenolone |
− | * | + | * LIPID_MAPS : LMST02030088 |
− | * | + | * PUBCHEM: |
− | ** [http:// | + | ** [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] |
− | ** [http://www. | + | * CHEMSPIDER: |
− | * | + | ** [http://www.chemspider.com/Chemical-Structure.8611.html 8611] |
− | ** [http://www. | + | * CHEBI: |
− | + | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=16581 16581] | |
− | * | + | * METABOLIGHTS : MTBLC16581 |
− | ** [http://www. | + | {{#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}} | |
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Revision as of 10:56, 18 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.