CHEBI:182641 - 6-acetyloxy-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid

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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 6-acetyloxy-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
ChEBI ID CHEBI:182641
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C22H32O4
Net Charge 0
Average Mass 360.494
Monoisotopic Mass 360.23006
InChI InChI=1S/C22H32O4/c1-6-20(3)13-15-8-9-17-21(4,10-7-11-22(17,5)19(24)25)16(15)12-18(20)26-14(2)23/h6,8,16-18H,1,7,9-13H2,2-5H3,(H,24,25)
InChIKey TUKYTUMQZQFKNX-UHFFFAOYSA-N
SMILES O(C1CC2C3(C(C(CCC3)(C)C(O)=O)CC=C2CC1(C)C=C)C)C(=O)C
ChEBI Ontology
Outgoing 6-acetyloxy-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid (CHEBI:182641) is a diterpenoid (CHEBI:23849)
IUPAC Name
6-acetyloxy-7-ethenyl-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
Manual Xref Database
22370418 ChemSpider
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