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CHEBI:45832 - SORANGICIN A

Default Structure
ChEBI IDCHEBI:45832
ChEBI NameSORANGICIN A
Stars
DownloadsMolfile
FormulaC47H66O11
Net Charge0
Average Mass807.034
Monoisotopic Mass806.46051
SMILES[H]OC(=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])[C@]([H])(/C([H])=C(\C([H])([H])[H])[C@]1([H])O[C@]2([H])C([H])=C([H])[C@]1([H])OC(=O)/C([H])=C([H])\C([H])=C([H])/C([H])=C(\[H])[C@@]1([H])O[C@]3([H])C([H])([H])[C@@]1([H])O[C@@]([H])(/C([H])=C(\[H])C([H])([H])[C@@]1([H])O[C@]([H])(C([H])([H])[C@]([H])(O[H])[C@@]1([H])C([H])([H])[H])[C@@]([H])(O[H])[C@@]([H])(O[H])/C([H])=C(\[H])C([H])([H])C([H])([H])/C([H])=C(\[H])C2([H])[H])[C@]3([H])C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C47H66O11/c1-30(17-14-15-23-44(50)51)27-31(2)47-40-26-25-34(54-47)18-10-6-5-7-11-19-35(48)46(53)43-28-36(49)32(3)37(56-43)21-16-22-38-33(4)41-29-42(55-38)39(57-41)20-12-8-9-13-24-45(52)58-40/h6,8-13,16,19-20,22,24-27,30,32-43,46-49,53H,5,7,14-15,17-18,21,23,28-29H2,1-4H3,(H,50,51)/b9-8-,10-6+,19-11+,20-12+,22-16+,24-13-,31-27+/t30-,32-,33+,34+,35+,36+,37-,38+,39-,40+,41-,42-,43-,46+,47+/m1/s1
InChIKeyOTABDKFPJQZJRD-QLGZCQHWSA-N
ChEBI Ontology
Outgoing Relation(s)
SORANGICIN A (CHEBI:45832) is a unclassifieds (CHEBI:27189)
Synonym  Source
SORANGICIN APDBeChem
Manual XrefsDatabases
SRNPDBeChem