CHEBI:140787 - osas#10

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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 osas#10
ChEBI ID CHEBI:140787
Stars This entity has been manually annotated by a third party.
Submitter Michael Witting
Supplier Information
Download Molfile XML SDF
Formula C27H41NO10
Net Charge 0
Average Mass 539.616
Monoisotopic Mass 539.27305
InChI InChI=1S/C27H41NO10/c1-17(7-5-3-4-6-8-25(33)34)36-27-21(30)15-23(18(2)37-27)38-26(35)14-13-24(32)28-16-22(31)19-9-11-20(29)12-10-19/h9-12,17-18,21-23,27,29-31H,3-8,13-16H2,1-2H3,(H,28,32)(H,33,34)/t17?,18?,21?,22-,23+,27+/m0/s1
InChIKey SCVSSJPXRIMMTB-QHPTULIBSA-N
SMILES [H]C(C)(CCCCCCC(O)=O)O[C@]1([H])OC([H])(C)[C@@]([H])(CC1([H])O)OC(=O)CCC(=O)NC[C@]([H])(O)C2=CC=C(O)C=C2
ChEBI Ontology
Outgoing osas#10 (CHEBI:140787) is a organic molecular entity (CHEBI:50860)