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(25R)-cholest-5-en-3beta,7alpha,26-triol

MNXM730412 is deprecated and replaced by MNXM1104086
PropertiesImage
MNX_IDMNXM1104086 Image of MNXM1104086
referencechebi:76592
formulaC27H46O3
global charge0
mol weight418.662
InChIKeyRXMHNAKZMGJANZ-GNENNHQYSA-N
InChIInChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h15,17-18,20-25,28-30H,5-14,16H2,1-4H3/t17-,18-,20+,21-,22+,23+,24-,25+,26+,27-/m1/s1
SMILESC[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C27H46O3/c1-17(16-28)6-5-7-18(2)21-8-9-22-25-23(11-13-27(21,22)4)26(3)12-10-20(29)14-19(26)15-24(25)30/h15,17-18,20-25,28-30H,5-14,16H2,1-4H3/t17-,18-,20+,21-,22+,23+,24-,25+,26+,27-/m1/s1 Image of MNXM1104086
SMILES (mnx)[CH3:1][C@H:17]([CH2:6][CH2:5][CH2:7][C@@H:18]([CH3:2])[C@H:21]1[CH2:8][CH2:9][C@H:22]2[C@H:25]3[C@H:23]([CH2:11][CH2:13][C@:27]12[CH3:4])[C@@:26]1([CH3:3])[CH2:12][CH2:10][C@H:20]([OH:29])[CH2:14][C:19]1=[CH:15][C@H:24]3[OH:30])[CH2:16][OH:28]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)12
in models (compartimentalized) 10
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:76592
chebi:76592
RXMHNAKZMGJANZ-GNENNHQYSA-N 		(25R)-cholest-5-en-3beta,7alpha,26-triol
(25R)-7alpha,26-dihydroxycholesterol
(25R)-cholest-5-ene-3beta,7alpha,26-triol
(3beta,7alpha,25R)-cholest-5-ene-3,7,26-triol

metacyc.compound:7-ALPHA27-DIHYDROXYCHOLESTEROL
metacycM:7-ALPHA27-DIHYDROXYCHOLESTEROL
RXMHNAKZMGJANZ-GNENNHQYSA-N 		(25R)-7alpha,26-dihydroxycholesterol
(25R)-7alpha,27-dihydroxycholesterol
(25R)-cholest-5-ene-3beta,7alpha,26-triol
(25R)-cholest-5-ene-3beta,7alpha,27-triol

SLM:000399822
slm:000399822
RXMHNAKZMGJANZ-GNENNHQYSA-N 		(25R)-cholest-5-ene-3beta,7alpha,26-triol
hmdb:HMDB0006281
RXMHNAKZMGJANZ-DTTSCKGMSA-N 		7-a,27-Dihydroxycholesterol
(1S,2R,5S,9S,10S,11S,14R,15R)-14-[(2R)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-ene-5,9-diol
5-Cholestene-3b,7a,26-triol
5-Cholestene-3beta,7alpha,26-triol
7-alpha,27-Dihydroxycholesterol
7-alpha,27-dihydroxycholesterol
7alpha,26-Dihydroxycholesterol
7alpha,27-Dihydroxycholesterol
7alpha,27-dihydroxycholesterol
Cholest-5-ene-3,7,27-triol
Cholest-5-ene-3- b,7-a,27-triol
Cholest-5-ene-3-b,7-a,27-triol
Cholest-5-ene-3-beta,7-alpha,27-triol
Cholest-5-ene-3b,7a,26-triol
Cholest-5-ene-3b,7a,27-triol
Cholest-5-ene-3beta,7alpha,26-triol
Cholest-5-ene-3beta,7alpha,27-triol

bigg.metabolite:xoltri27
biggM:xoltri27
sabiork.compound:8559
sabiorkM:8559
RXMHNAKZMGJANZ-DTTSCKGMSA-N 		7-alpha,27-Dihydroxycholesterol

lipidmaps:LMST01010462
lipidmapsM:LMST01010462
RXMHNAKZMGJANZ-GNENNHQYSA-N 		7alpha,25(R)26-dihydroxycholesterol
(25R)-Cholest-5-en-3beta,7alpha,26-triol
O3
ST 27:1

vmhM:xoltri27
vmhmetabolite:xoltri27
RXMHNAKZMGJANZ-JEXBXRCOSA-N 		7alpha,26-dihydroxycholesterol
(1S,2R,5S,9S,10S,11S,14R,15R)-14-[(2R)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-ene-5,9-diol

reactome:R-ALL-192194
reactomeM:R-ALL-192194
CHEBI:18431
chebi:18431
RXMHNAKZMGJANZ-DTTSCKGMSA-N 		7alpha,26-dihydroxycholesterol
5-cholestene-3beta,7alpha,26-triol
7-alpha,27-Dihydroxycholesterol
Cholest-5-ene-3beta,7alpha,26-triol
Cholest-5-ene-3beta,7alpha,27-triol
cholest-5-ene-3beta,7alpha,26-triol

seed.compound:cpd03782
seedM:cpd03782
RXMHNAKZMGJANZ-GNENNHQYSA-N 		7alpha,27-Dihydroxycholesterol
(25R)-7alpha,26-dihydroxycholesterol
(25R)-7alpha,27-dihydroxycholesterol
(25R)-cholest-5-ene-3beta,7alpha,26-triol
(25R)-cholest-5-ene-3beta,7alpha,27-triol
7-alpha,27-dihydroxycholesterol
Cholest-5-ene-3beta,7alpha,26-triol
Cholest-5-ene-3beta,7alpha,27-triol
cholest-5-ene-3beta,7alpha,27-triol

kegg.compound:C06341
keggC:C06341
RXMHNAKZMGJANZ-DTTSCKGMSA-N 		7alpha,27-Dihydroxycholesterol
Cholest-5-ene-3beta,7alpha,26-triol
Cholest-5-ene-3beta,7alpha,27-triol

vmhM:CE5530
vmhmetabolite:CE5530
RXMHNAKZMGJANZ-JEXBXRCOSA-N 		7alpha,27-dihydroxycholesterol
(1S,2R,5S,9S,10S,11S,14R,15R)-14-[(2R)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-7-ene-5,9-diol

lipidmaps:LMST04030081
lipidmapsM:LMST04030081
RXMHNAKZMGJANZ-DTTSCKGMSA-N 		7alpha,27-dihydroxycholesterol
5-Cholestene-3beta,7alpha,26-triol
7alpha,26-dihydroxycholesterol
O3
ST 27:1

hmdb:HMDB06281
chebi:12261
chebi:20798
chebi:2284
biggM:M_xoltri27
keggC:M_C06341
seedM:M_cpd03782
vmhM:M_CE5530
vmhM:M_xoltri27 		secondary/obsolete/fantasy identifier