CHEBI:212984 - Radarin C

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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 Radarin C
ChEBI ID CHEBI:212984
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C28H39NO
Net Charge 0
Average Mass 405.626
Monoisotopic Mass 405.30316
InChI InChI=1S/C28H39NO/c1-18-12-14-27(4)24-11-10-23(30)19(2)26(24,3)15-13-25(27)28(18,5)16-20-17-29-22-9-7-6-8-21(20)22/h6-9,17-19,24-25,29H,10-16H2,1-5H3/t18-,19+,24-,25+,26-,27+,28+/m1/s1
InChIKey ZEETTZHRLKVSNU-PNZHDMLZSA-N
SMILES O=C1[C@@H]([C@@]2([C@H]([C@]3([C@@H]([C@]([C@H](C)CC3)(CC=4C5=C(C=CC=C5)NC4)C)CC2)C)CC1)C)C
Metabolite of Species Details
Aspergillus sulphureus (NCBI:txid138284) See: DOI
ChEBI Ontology
Outgoing Radarin C (CHEBI:212984) is a diterpenoid (CHEBI:23849)
IUPAC Name
(1R,4aS,4bR,7R,8S,8aR,10aS)-8-(1H-indol-3-ylmethyl)-1,4b,7,8,10a-pentamethyl-1,3,4,4a,5,6,7,8a,9,10-decahydrophenanthren-2-one
Manual Xref Database
10249642 ChemSpider
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