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CHEBI:201800 - Tetromycin B

ChEBI IDCHEBI:201800
ChEBI NameTetromycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H46O5
Net Charge0
Average Mass534.737
Monoisotopic Mass534.33452
SMILESCC1=CC2(C)C=C(C)C(C)CC23OC(=O)C(=C(O)C2(C)C(C(C)=CCC1)C(C)=CC1C(O)CCC(C)C12)C3=O
InChIInChI=1S/C34H46O5/c1-18-10-9-11-19(2)27-21(4)14-24-25(35)13-12-20(3)28(24)33(27,8)29(36)26-30(37)34(39-31(26)38)17-23(6)22(5)16-32(34,7)15-18/h11,14-16,20,23-25,27-28,35-36H,9-10,12-13,17H2,1-8H3
InChIKeyDACFQDZSKBTCCU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Tetromycin B (CHEBI:201800) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
(1S,3R,6R,7Z,11Z,13R,16S,17S,20S,21R,22S,23Z)-17,23-dihydroxy-3,4,6,8,12,14,20,22-octamethyl-26-oxapentacyclo[22.2.1.01,6.013,22.016,21]heptacosa-4,7,11,14,23-pentaene-25,27-dione