CHEBI:200667 - Indosespene

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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 Indosespene
ChEBI ID CHEBI:200667
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C23H29NO3
Net Charge 0
Average Mass 367.489
Monoisotopic Mass 367.21474
InChI InChI=1S/C23H29NO3/c1-14-8-9-19-22(2,11-10-20(25)23(19,3)21(26)27)17(14)12-15-13-24-18-7-5-4-6-16(15)18/h4-7,13,17,19-20,24-25H,1,8-12H2,2-3H3,(H,26,27)/t17-,19+,20-,22+,23-/m0/s1
InChIKey QDZOYOCJZCVSSV-BZJMLBMJSA-N
SMILES O=C(O)[C@@]1([C@@H](O)CC[C@]2([C@H]1CCC([C@@H]2CC=3C4=C(C=CC=C4)NC3)=C)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Indosespene (CHEBI:200667) is a indoles (CHEBI:24828)
IUPAC Name
(1S,2S,4aR,5S,8aR)-2-hydroxy-5-(1H-indol-3-ylmethyl)-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
Manual Xref Database
27025490 ChemSpider
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