Search MNXref
 Feedback

4alpha,14alpha,23S-trimethyl-sitosterol

PropertiesImage
MNX_IDMNXM1131904 Image of MNXM1131904
referencelipidmapsM:LMST01040276
formulaC32H56O
global charge0
mol weight456.799
InChIKeyZYVAMJVJKUACRH-LPJIZJEVSA-N
InChIInChI=1S/C32H56O/c1-10-24(20(2)3)21(4)19-22(5)25-13-17-32(9)28-12-11-26-23(6)29(33)15-16-30(26,7)27(28)14-18-31(25,32)8/h11,20-25,27-29,33H,10,12-19H2,1-9H3/t21-,22+,23-,24-,25+,27-,28+,29-,30-,31+,32-/m0/s1
SMILESCC[C@@H](C(C)C)[C@@H](C)C[C@@H](C)[C@H]1CC[C@@]2(C)[C@@H]3CC=C4[C@H](C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C32H56O/c1-10-24(20(2)3)21(4)19-22(5)25-13-17-32(9)28-12-11-26-23(6)29(33)15-16-30(26,7)27(28)14-18-31(25,32)8/h11,20-25,27-29,33H,10,12-19H2,1-9H3/t21-,22+,23-,24-,25+,27-,28+,29-,30-,31+,32-/m0/s1 Image of MNXM1131904
SMILES (mnx)[CH3:1][CH2:10][C@@H:24]([CH:20]([CH3:2])[CH3:3])[C@@H:21]([CH3:4])[CH2:19][C@@H:22]([CH3:5])[C@H:25]1[CH2:13][CH2:17][C@@:32]2([CH3:9])[C@@H:28]3[CH2:12][CH:11]=[C:26]4[C@H:23]([CH3:6])[C@@H:29]([OH:33])[CH2:15][CH2:16][C@:30]4([CH3:7])[C@H:27]3[CH2:14][CH2:18][C@:31]12[CH3:8]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

lipidmaps:LMST01040276
lipidmapsM:LMST01040276
ZYVAMJVJKUACRH-LPJIZJEVSA-N
4alpha,14alpha,23S-trimethyl-sitosterol
4alpha,14alpha,23S-trimethyl-stigmast-5-en-3beta-ol
O
ST 32:1