Terminology Service for NFDI4Health
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brassicasterol 3-beta-D-glucoside

Go to external page http://purl.obolibrary.org/obo/CHEBI_145041

Term info

Label

brassicasterol 3-beta-D-glucoside

Synonyms
  • brassicasterol 3-beta-D-glucoside
database cross reference
Subsets

2_STAR

charge

0

formula

C34H56O6

has obo namespace

chebi_ontology

id

CHEBI:145041

inchi

InChI=1S/C34H56O6/c1-19(2)20(3)7-8-21(4)25-11-12-26-24-10-9-22-17-23(13-15-33(22,5)27(24)14-16-34(25,26)6)39-32-31(38)30(37)29(36)28(18-35)40-32/h7-9,19-21,23-32,35-38H,10-18H2,1-6H3/b8-7+/t20-,21+,23-,24-,25+,26-,27-,28+,29+,30-,31+,32+,33-,34+/m0/s1

inchikey

ILUZPRRJJSFYEH-OBNQGTFASA-N

mass

560.816

monoisotopicmass

560.40769

smiles

[C@@]12([C@]3([C@@]([C@@]4(C(C[C@@H](O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)CC4)=CC3)C)(CC[C@@]1([C@@]([C@@H](/C=C/[C@@H](C(C)C)C)C)(CC2)[H])C)[H])[H])[H]