CHEBI:69633 - 3β-acetoxy-7β,15α,22-trihydroxyhopane

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ChEBI Name 3β-acetoxy-7β,15α,22-trihydroxyhopane
ChEBI ID CHEBI:69633
ChEBI ASCII Name 3beta-acetoxy-7beta,15alpha,22-trihydroxyhopane
Definition A hopanoid that is hopane substituted by an acetoxy group at position 3 and hydroxy groups at positions 7, 15 and 22 respectively (the 3β,7β,15α-stereoisomer). It has been isolated from Hypocrella species.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C32H54O5
Net Charge 0
Average Mass 518.76820
Monoisotopic Mass 518.39712
InChI InChI=1S/C32H54O5/c1-18(33)37-26-13-15-30(7)22-11-10-21-29(6)14-12-19(28(4,5)36)20(29)16-24(34)31(21,8)32(22,9)25(35)17-23(30)27(26,2)3/h19-26,34-36H,10-17H2,1-9H3/t19-,20-,21+,22+,23-,24-,25-,26-,29-,30+,31-,32-/m0/s1
InChIKey NUCRCPGDAUKOEZ-KJMMORIQSA-N
SMILES CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](C[C@H](O)[C@]3(C)[C@@H]2CC[C@@H]2[C@@]4(C)CC[C@@H]([C@@H]4C[C@H](O)[C@@]32C)C(C)(C)O)C1(C)C
Metabolite of Species Details
Hypocrella (NCBI:txid42305) Found in mycelium (BTO:0001436). The fungus was isolated form scale insect of strain BCC 14524 See: PubMed
Roles Classification
Biological Role(s): 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 3β-acetoxy-7β,15α,22-trihydroxyhopane (CHEBI:69633) has role fungal metabolite (CHEBI:76946)
3β-acetoxy-7β,15α,22-trihydroxyhopane (CHEBI:69633) is a acetate ester (CHEBI:47622)
3β-acetoxy-7β,15α,22-trihydroxyhopane (CHEBI:69633) is a hopanoid (CHEBI:51963)
3β-acetoxy-7β,15α,22-trihydroxyhopane (CHEBI:69633) is a pentacyclic triterpenoid (CHEBI:25872)
3β-acetoxy-7β,15α,22-trihydroxyhopane (CHEBI:69633) is a triol (CHEBI:27136)
IUPAC Name
(3β,7β,15α)-7,15,22-trihydroxyhopan-3-yl acetate
Registry Number Type Source
21969325 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
21995505 PubMed citation Europe PMC
Last Modified
26 May 2015