CHEBI:70542 - wikstroelide E

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ChEBI Name wikstroelide E
ChEBI ID CHEBI:70542
Definition A natural product found particularly in Wikstroemia retusa and Pimelea simplex.
Stars This entity has been manually annotated by a third party.
Supplier Information ChemicalBook:CB6147431, eMolecules:500375, ZINC000000163290
Download Molfile XML SDF
Formula C30H44O8
Net Charge 0
Average Mass 532.66560
Monoisotopic Mass 532.30362
InChI InChI=1S/C30H44O8/c1-15(2)26-13-17(4)30-20-23(26)36-28(37-26,38-30)12-10-8-6-7-9-11-16(3)19-18(5)22(32)29(34,21(19)30)25(33)27(14-31)24(20)35-27/h16-21,23-25,31,33-34H,1,6-14H2,2-5H3/t16-,17+,18-,19-,20+,21+,23+,24-,25+,26+,27-,28?,29+,30+/m0/s1
InChIKey YTMZOVBDBJZQRD-FHUSGCSVSA-N
SMILES [H][C@]12[C@@H](C)CCCCCCC[C@@]34O[C@@H]5[C@]6([H])[C@]7([H])O[C@]7(CO)[C@@H](O)[C@](O)(C(=O)[C@H]1C)[C@]2([H])[C@@]6(O3)[C@H](C)C[C@@]5(O4)C(C)=C
Metabolite of Species Details
Pimelea elongata (IPNI:74472-3) Found in foliage leaf (PO:0009025). Airdried and milled foliage was soaked in 90% MeOH and extracted with MeOH See: PubMed
Wikstroemia retusa (IPNI:833174-1) See: PubMed
Pimelea simplex (NCBI:txid746341) See: PubMed
Roles Classification
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing wikstroelide E (CHEBI:70542) has role metabolite (CHEBI:25212)
wikstroelide E (CHEBI:70542) is a diterpenoid (CHEBI:23849)
Synonym Source
pimelea factor S7 ChEBI
Citation Waiting for Citations
Last Modified
22 September 2014
General Comment
2014-10-17 Suggested Classification: ISA:ortho ester(CHEBI:71989); ISA:oxacycle(CHEBI:38104); ISA:dioxanes(CHEBI:46926); ISA:tertiary alcohol(CHEBI:26878); ISA:dioxolane(CHEBI:39430); ISA:secondary alcohol(CHEBI:35681); ISA:organic hydroxy compound(CHEBI:33822); ISA:ketone(CHEBI:17087); ISA:polyol(CHEBI:26191); ISA:epoxide(CHEBI:32955); ISA:ether(CHEBI:25698); ISA:primary alcohol(CHEBI:15734);