CHEBI:138974 - mogrol

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ChEBI Name mogrol
ChEBI ID CHEBI:138974
Definition A tetracyclic triterpenoid that is cucurbitadienol in which the side-chain double bond (position 24-25) has undergone formal oxidation to introduce hydroxy groups at positions 24 and 25 (the 24R stereoisomer). It is a biometabolite of mogrosides found in Siraitia grosvenorii.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C30H52O4
Net Charge 0
Average Mass 476.733
Monoisotopic Mass 476.38656
InChI InChI=1S/C30H52O4/c1-18(9-13-24(32)27(4,5)34)19-15-16-28(6)22-12-10-20-21(11-14-23(31)26(20,2)3)30(22,8)25(33)17-29(19,28)7/h10,18-19,21-25,31-34H,9,11-17H2,1-8H3/t18-,19-,21-,22+,23+,24-,25-,28+,29-,30+/m1/s1
InChIKey JLYBBRAAICDTIS-AYEHCKLZSA-N
SMILES [C@@]12(C)[C@]3([C@]([C@@]4(CC[C@@H](C(C4=CC3)(C)C)O)[H])([C@@H](C[C@]2(C)[C@](CC1)([C@@H](CC[C@H](C(C)(C)O)O)C)[H])O)C)[H]
Roles Classification
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing mogrol (CHEBI:138974) has functional parent cucurbitadienol (CHEBI:62456)
mogrol (CHEBI:138974) has role antineoplastic agent (CHEBI:35610)
mogrol (CHEBI:138974) is a hydroxy seco-steroid (CHEBI:36853)
mogrol (CHEBI:138974) is a tetracyclic triterpenoid (CHEBI:26893)
Incoming mogroside IE (CHEBI:138975) has functional parent mogrol (CHEBI:138974)
IUPAC Name
(1S,4R,9β,11α,24R)-9,10,14-trimethyl-4,9-cyclo-9,10-secocholest-5-ene-1,11,24,25-tetrol
Synonyms Sources
(24R)-cucurbit-5-ene-3β,11α,24,25-tetraol ChEBI
mogrol UniProt
Manual Xref Database
CPD-20463 MetaCyc
View more database links
Registry Number Type Source
9101900 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11809458 PubMed citation Europe PMC
12405766 PubMed citation Europe PMC
25759326 PubMed citation SUBMITTER
26101699 PubMed citation Europe PMC
27583359 PubMed citation SUBMITTER
27884874 PubMed citation Europe PMC
Last Modified
17 January 2018