CHEBI:141365 - sclerodol B

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ChEBI Name sclerodol B
ChEBI ID CHEBI:141365
Definition A 3β-hydroxy steroid that is (3β,5α)-4,4,14-trimethylandrost-8-en-3-ol which is substituted by a (3E,6S)-2-methoxy-2-methylhept-3-en-6-yl group at position 17.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter R. Stephan
Supplier Information
Download Molfile XML SDF
Formula C31H52O2
Net Charge 0
Average Mass 456.745
Monoisotopic Mass 456.39673
InChI InChI=1S/C31H52O2/c1-21(11-10-17-27(2,3)33-9)22-14-19-31(8)24-12-13-25-28(4,5)26(32)16-18-29(25,6)23(24)15-20-30(22,31)7/h10,17,21-22,25-26,32H,11-16,18-20H2,1-9H3/b17-10+/t21-,22-,25+,26+,29-,30-,31+/m1/s1
InChIKey KMUGSJNEBPVLKO-PWUQRKGSSA-N
SMILES C1[C@]2([C@](C([C@H](C1)O)(C)C)(CCC3=C2CC[C@@]4(C)[C@@]3(C)CC[C@@]4([C@@H](C/C=C/C(OC)(C)C)C)[H])[H])C
Metabolite of Species Details
Scleroderma sp. UFSMSc1 (NCBI:txid436453) See: PubMed
Roles Classification
Biological Role(s): antifungal agent
An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce.
fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sclerodol B (CHEBI:141365) has parent hydride lanostane (CHEBI:20265)
sclerodol B (CHEBI:141365) has role antifungal agent (CHEBI:35718)
sclerodol B (CHEBI:141365) has role fungal metabolite (CHEBI:76946)
sclerodol B (CHEBI:141365) is a 3β-hydroxy steroid (CHEBI:36836)
sclerodol B (CHEBI:141365) is a ether (CHEBI:25698)
sclerodol B (CHEBI:141365) is a tetracyclic triterpenoid (CHEBI:26893)
IUPAC Name
(3β,23E)-25-methoxylanosta-8,23-dien-3-ol
Synonym Source
sclerodol B ChEBI
Registry Number Type Source
29689270 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
26826733 PubMed citation SUBMITTER
Last Modified
17 August 2023