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(25R)-4beta,26-dihydroxycholesterol

PropertiesImage
MNX_IDMNXM145956 Image of MNXM145956
referencechebi:86113
formulaC27H46O3
global charge0
mol weight418.662
InChIKeyIDLRVFXWSUWMHI-KUYJPBLDSA-N
InChIInChI=1S/C27H46O3/c1-17(16-28)6-5-7-18(2)20-10-11-21-19-8-9-23-25(30)24(29)13-15-27(23,4)22(19)12-14-26(20,21)3/h9,17-22,24-25,28-30H,5-8,10-16H2,1-4H3/t17-,18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1
SMILESC[C@@H](CO)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4[C@@H](O)[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)20-10-11-21-19-8-9-23-25(30)24(29)13-15-27(23,4)22(19)12-14-26(20,21)3/h9,17-22,24-25,28-30H,5-8,10-16H2,1-4H3/t17-,18-,19+,20-,21+,22+,24+,25-,26-,27-/m1/s1 Image of MNXM145956
SMILES (mnx)[CH3:1][C@H:17]([CH2:6][CH2:5][CH2:7][C@@H:18]([CH3:2])[C@H:20]1[CH2:10][CH2:11][C@H:21]2[C@@H:19]3[CH2:8][CH:9]=[C:23]4[C@@H:25]([OH:30])[C@@H:24]([OH:29])[CH2:13][CH2:15][C@:27]4([CH3:4])[C@H:22]3[CH2:12][CH2:14][C@:26]12[CH3:3])[CH2:16][OH:28]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:86113
chebi:86113
IDLRVFXWSUWMHI-KUYJPBLDSA-N 		(25R)-4beta,26-dihydroxycholesterol
(25R)-cholest-5-ene-3beta,4beta,26-triol
(3beta,4beta,25R)-cholest-5-ene-3,4,26-triol

SLM:000485351
slm:000485351
IDLRVFXWSUWMHI-KUYJPBLDSA-N 		(25R)-4beta,26-dihydroxycholesterol
hmdb:HMDB0062607
IDLRVFXWSUWMHI-KUYJPBLDSA-N 		(25R)-4beta,26-dihydroxycholesterol
(1S,2R,5S,6R,10S,11S,14R,15R)-14-[(2R,6R)-7-hydroxy-6-methylheptan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-7-ene-5,6-diol
(25R)-4b,26-Dihydroxycholesterol
(3b,4b,25R)-Cholest-5-ene-3,4,26-triol
(3beta,4beta,25R)-Cholest-5-ene-3,4,26-triol
(3beta,4beta,25R)-cholest-5-ene-3,4,26-triol

hmdb:HMDB62607 		secondary/obsolete/fantasy identifier