CHEBI:197690 - Punctaporonin H

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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 Punctaporonin H
ChEBI ID CHEBI:197690
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H26O5
Net Charge 0
Average Mass 310.390
Monoisotopic Mass 310.17802
InChI InChI=1S/C17H26O5/c1-11(19)22-14-9-16(4,20)7-5-6-12(10-18)13-8-15(2,3)17(13,14)21/h5-7,13-14,18,20-21H,8-10H2,1-4H3/b7-5-,12-6-/t13-,14+,16-,17-/m1/s1
InChIKey KVKXBJRFFOSVQZ-IIBQJXEOSA-N
SMILES O=C(O[C@@H]1[C@@]2(O)C(C[C@@H]2C(=CC=C[C@](C1)(O)C)CO)(C)C)C
Metabolite of Species Details
Ascotricha sinuosa (NCBI:txid1217297) See: PubMed
ChEBI Ontology
Outgoing Punctaporonin H (CHEBI:197690) is a tertiary alcohol (CHEBI:26878)
IUPAC Name
[(1S,2S,4S,5Z,7E,9R)-1,4-dihydroxy-8-(hydroxymethyl)-4,11,11-trimethyl-2-bicyclo[7.2.0]undeca-5,7-dienyl] acetate
Manual Xref Database
34981961 ChemSpider
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