CHEBI:145197 - Mogroside II-A1

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Mogroside II-A1
ChEBI ID CHEBI:145197
Stars This entity has been manually annotated by a third party.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
Formula C42H72O14
Net Charge 0
Average Mass 801.024
Monoisotopic Mass 800.49221
InChI InChI=1S/C42H72O14/c1-20(21-15-16-40(6)26-12-10-22-23(11-13-27(43)38(22,2)3)42(26,8)28(44)17-41(21,40)7)9-14-29(39(4,5)52)53-18-25-31(46)33(48)35(50)37(56-25)54-19-24-30(45)32(47)34(49)36(51)55-24/h10,20-21,23-37,43-52H,9,11-19H2,1-8H3/t20-,21-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32+,33-,34-,35+,36-,37+,40+,41-,42+/m1/s1
InChIKey PFGGLVMSSIGPIQ-HPIAQRLDSA-N
SMILES O[C@H]1[C@@]2([C@]([C@]3([C@@]([C@](CC3)([C@@H](CC[C@@H](OC[C@@H]4O[C@H](OC[C@H]5O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]5O)[C@@H](O)[C@H](O)[C@H]4O)C(O)(C)C)C)[H])(C1)C)C)(CC=C6[C@]2(CC[C@H](O)C6(C)C)[H])[H])C
Metabolite of Species Details
Momordica charantia (NCBI:txid3673) Found in seed (BTO:0001226). See: MetaboLights Study
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via saponin )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Mogroside II-A1 (CHEBI:145197) is a β-D-glucoside (CHEBI:22798)
Mogroside II-A1 (CHEBI:145197) is a 3-hydroxy steroid (CHEBI:36834)
Mogroside II-A1 (CHEBI:145197) is a disaccharide derivative (CHEBI:63353)
Mogroside II-A1 (CHEBI:145197) is a steroid saponin (CHEBI:61655)
Synonym Source
mogroside II-A1 UniProt
Last Modified
27 March 2024