Difference between revisions of "CPD-8612"
From metabolic_network
(Created page with "Category:Metabolite == Metabolite [http://metacyc.org/META/NEW-IMAGE?object=CPD-8612 CPD-8612] == * smiles: ** CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH...") |
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| Line 3: | Line 3: | ||
* smiles: | * smiles: | ||
** CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C | ** CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C | ||
| + | * molecular weight: | ||
| + | ** 428.697 | ||
* inchi key: | * inchi key: | ||
** InChIKey=WWTBBRMTEFBUND-WKYRUEGDSA-N | ** InChIKey=WWTBBRMTEFBUND-WKYRUEGDSA-N | ||
* common name: | * common name: | ||
** 4α-formyl-4β-methyl-5α-cholesta-8-en-3β-ol | ** 4α-formyl-4β-methyl-5α-cholesta-8-en-3β-ol | ||
| − | |||
| − | |||
* Synonym(s): | * Synonym(s): | ||
| Line 17: | Line 17: | ||
== Reaction(s) of unknown directionality == | == Reaction(s) of unknown directionality == | ||
== External links == | == External links == | ||
| − | |||
| − | |||
* CHEBI: | * CHEBI: | ||
** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87046 87046] | ** [http://www.ebi.ac.uk/chebi/searchId.do?chebiId=87046 87046] | ||
| + | * PUBCHEM: | ||
| + | ** [http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?cid=44263319 44263319] | ||
* HMDB : HMDB12168 | * HMDB : HMDB12168 | ||
{{#set: smiles=CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C}} | {{#set: smiles=CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C}} | ||
| + | {{#set: molecular weight=428.697 }} | ||
{{#set: inchi key=InChIKey=WWTBBRMTEFBUND-WKYRUEGDSA-N}} | {{#set: inchi key=InChIKey=WWTBBRMTEFBUND-WKYRUEGDSA-N}} | ||
{{#set: common name=4α-formyl-4β-methyl-5α-cholesta-8-en-3β-ol}} | {{#set: common name=4α-formyl-4β-methyl-5α-cholesta-8-en-3β-ol}} | ||
| − | |||
{{#set: consumed by=RXN66-17}} | {{#set: consumed by=RXN66-17}} | ||
{{#set: produced by=RXN66-16}} | {{#set: produced by=RXN66-16}} | ||
Latest revision as of 14:58, 9 January 2019
Contents
Metabolite CPD-8612
- smiles:
- CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C
- molecular weight:
- 428.697
- inchi key:
- InChIKey=WWTBBRMTEFBUND-WKYRUEGDSA-N
- common name:
- 4α-formyl-4β-methyl-5α-cholesta-8-en-3β-ol
- Synonym(s):
Reaction(s) known to consume the compound
Reaction(s) known to produce the compound
Reaction(s) of unknown directionality
External links
"CC(C)CCCC([CH]4(C1(C)([CH](C2(=C(CC1)C3(C)([CH](CC2)C(C)([CH]=O)C(O)CC3)))CC4)))C" cannot be used as a page name in this wiki.
