MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks
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cholest-5,24-dien-3beta-yl beta-D-glucopyranoside
Properties
Image
Occurences in reactions
MNX_ID
MNXM25563
#reac
in my sandbox
0
in MNXref (generic)
0
in models (compartimentalized)
0
formula
C
33
H
54
O
6
charge
0
mass
546.39204
reference
lipidmapsM:LMST01010348
InChIKey
QSPACSWMSZHXLY-WWHLXHPUSA-N
InChI
InChI=1S/C33H54O6/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(13-15-32(21,4)26(23)14-16-33(24,25)5)38-31-30(37)29(36)28(35)27(18-34)39-31/h7,9,20,22-31,34-37H,6,8,10-18H2,1-5H3/t20-,22+,23+,24-,25+,26+,27?,28-,29?,30?,31-,32+,33-/m1/s1
SMILES
CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@@H]5OC(CO)[C@@H](O)C(O)C5O)CC[C@]4(C)[C@H]3CC[C@@]21C
Parent-child relations graph
Deprecated MNXref IDs graph
Similar chemical compounds in external resources
Identifier
Description
lipidmaps:LMST01010348
lipidmapsM:LMST01010348
cholest-5,24-dien-3beta-yl beta-D-glucopyranoside
Hex
O
ST 27:2