Search MNXref
SystemsX.ch
The Swiss Initiative in Systems Biology
 Feedback

Cholestane-3,7,12,24,25-pentol

MNXM164359 is deprecated and here replaced by MNXM1105771
!!! Alternative mappings exist !!!
PropertiesImageOccurences in reactions
MNX_IDMNXM1105771Image of MNXM1105771
#reac
in my sandbox 0
in MNXref (generic)5
in models (compartimentalized) 8
formulaC27H48O5
charge0
mass452.35017
referencechebi:172123
InChIKeyNHPWQASMMFUHIZ-YBMOUMCLSA-N
InChIInChI=1S/C27H48O5/c1-15(6-9-22(30)25(2,3)32)18-7-8-19-24-20(14-23(31)27(18,19)5)26(4)11-10-17(28)12-16(26)13-21(24)29/h15-24,28-32H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20+,21-,22+,23+,24+,26+,27-/m1/s1
SMILESC[C@H](CC[C@H](O)C(C)(C)O)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:172123
chebi:172123 		Cholestane-3,7,12,24,25-pentol
(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
hmdb:HMDB0000556 5b-Cholestane-3a,7a,12a,24,25-pentol
(1S,2S,5R,9R,10R,11S,14R,15R,16S)-14-[(2R)-5,6-dihydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadecane-5,9,16-triol
3a,7a,12a,24,25-Pentahydroxycoprostane
3alpha,7alpha,12alpha,24R,25-Pentahydroxy-5beta-cholestane
5b-Cholestane-3a,7a,12a,24R,25-pentol
5beta-Cholestane-3alpha,7alpha,12alpha,24R,25-pentol
5beta-cholestane-3alpha,7alpha,12alpha,24R,25-pentol
CHEBI:172126
chebi:172126 		5b-Cholestane-3a,7a,12a,24,25-pentol
(3R,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-5,6-dihydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
bigg.metabolite:CE1279
biggM:CE1279 		5beta-cholestane-3alpha,7alpha,12alpha,24R,25-pentol
bigg.metabolite:CE1273
biggM:CE1273 		5beta-cholestane-3alpha,7alpha,12alpha,24S,25-pentol
hmdb:HMDB0002208 Cholestane-3,7,12,24,25-pentol
(1S,2S,5R,7S,9R,10R,11S,14R,15R,16S)-14-[(2R,5S)-5,6-dihydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecane-5,9,16-triol
3alpha,7alpha,12alpha,24S,25-Pentahydroxy-5beta-cholestane
5-beta-Cholestane-3 alpha,7 alpha,12 alpha,24 beta,25-pentol
5-beta-Cholestane-3alpha,7alpha,12alpha,24beta,25-pentol
5beta-Cholestane-3alpha,7alpha,12alpha,24S,25-pentol
hmdb:HMDB00556
hmdb:HMDB02208
biggM:M_CE1273
biggM:M_CE1279 		secondary/obsolete/fantasy identifier