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H3CCH3(R)CH3(R)(S)(R)(S)O(S)H3C(S)(R)H3C

CAS RN 566-88-1

IUPAC Navn: (1R,3aS,3bR,5aS,9aS,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-hexadecahydro-1H-cyclopenta[a]phenanthren-7-one
Synonymer: coprostanone 5α-cholestanone (5α)-cholestanone 5a-cholestanone 5a(H)-cholestan-3-one 5a-cholestan-3-one
Molekylvægt (g/mol): 386.66
Molekylformel: C27H46O
InChi Key: PESKGJQREUXSRR-UXIWKSIVSA-N
SMILES: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
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1 – 3 af 3 Resultater
1

5alpha-Cholestan-3-one, 97%

CAS: 566-88-1 Molekylær formel: C27H46O Molekylvægt (g/mol): 386.664 MDL nummer: MFCD00065901 InChI nøgle: PESKGJQREUXSRR-UXIWKSIVSA-N Synonym: 5alpha-cholestan-3-one,5a-cholestan-3-one,5alpha-cholestanone,coprostanone,5alpha-cholestane-3-one,cholestan-3-one, 5a,3-keto-5alpha-cholestane,5-alpha-cholestan-3-one,cholestan-3-one PubChem CID: 92128 ChEBI: CHEBI:17762 IUPAC navn: (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tettraadecahydroen-cyclo-phentradecahydroen-3 SMIL: CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C

MDL nummer MFCD00065901
PubChem CID 92128
Molekylvægt (g/mol) 386.664
CAS 566-88-1
ChEBI CHEBI:17762
Synonym 5alpha-cholestan-3-one,5a-cholestan-3-one,5alpha-cholestanone,coprostanone,5alpha-cholestane-3-one,cholestan-3-one, 5a,3-keto-5alpha-cholestane,5-alpha-cholestan-3-one,cholestan-3-one
SMIL CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C
IUPAC navn (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tettraadecahydroen-cyclo-phentradecahydroen-3
InChI nøgle PESKGJQREUXSRR-UXIWKSIVSA-N
Molekylær formel C27H46O
2

5-a-Cholestan-3-one, TRC

CAS: 566-88-1 Molekylær formel: C27 H46 O Molekylvægt (g/mol): 386.65 Synonym: 5α-Cholestan-3-one IUPAC navn: (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one SMIL: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

Molekylvægt (g/mol) 386.65
CAS 566-88-1
Synonym 5α-Cholestan-3-one
SMIL CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
IUPAC navn (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Molekylær formel C27 H46 O
3

5-Alpha-Cholestan-3-one, TRC

CAS: 566-88-1 Molekylær formel: C27 H46 O Molekylvægt (g/mol): 386.65 Synonym: 5α-Cholestan-3-one IUPAC navn: (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one SMIL: CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C

Molekylvægt (g/mol) 386.65
CAS 566-88-1
Synonym 5α-Cholestan-3-one
SMIL CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C
IUPAC navn (5S,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one
Molekylær formel C27 H46 O