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CHEBI:2987 - Baliospermin

ChEBI IDCHEBI:2987
ChEBI NameBaliospermin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC32H50O8
Net Charge0
Average Mass562.744
Monoisotopic Mass562.35057
SMILES[H][C@@]12C=C(C)C(=O)[C@@]1(O)[C@H](O)[C@@]1(CO)O[C@@]1([H])[C@]1([H])[C@]2(O)[C@H](C)C[C@@]2(OC(=O)CCCCCCCCCCC)C(C)(C)[C@@]12[H]
InChIInChI=1S/C32H50O8/c1-6-7-8-9-10-11-12-13-14-15-22(34)39-30-17-20(3)31(37)21-16-19(2)25(35)32(21,38)27(36)29(18-33)26(40-29)23(31)24(30)28(30,4)5/h16,20-21,23-24,26-27,33,36-38H,6-15,17-18H2,1-5H3/t20-,21+,23-,24-,26+,27-,29+,30+,31+,32-/m1/s1
InChIKeyJGUYJMIAKPTIAH-MTAILJIJSA-N
ChEBI Ontology
Outgoing Relation(s)
Baliospermin (CHEBI:2987) is a monoterpenoid (CHEBI:25409)
Synonym  Source
BaliosperminKEGG COMPOUND
Manual XrefsDatabases
C09065KEGG COMPOUND
C00003406KNApSAcK
Registry NumbersSources
CAS:66583-56-0KEGG COMPOUND