(Q105140769)

English

(5S)-5-[(11S)-11-hydroxy-11-[(2S,5R)-5-[(2R,5S)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]undecyl]-3-(2-oxopropyl)oxolan-2-one

group of stereoisomers with the chemical formula C₃₇H₆₆O₇

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Statements

instance of

group of stereoisomers

0 references

1 reference

622.480854452 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₆₆O₇

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canonical SMILES

O=C(C)CC1C(=O)OC(CCCCCCCCCCC(O)C2OC(CC2)C3OC(CC3)C(O)CCCCCCCCCC)C1

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isomeric SMILES

CCCCCCCCCC[C@@H](O)[C@@H]1CC[C@H]([C@H]2CC[C@@H]([C@@H](O)CCCCCCCCCC[C@H]3CC(CC(C)=O)C(=O)O3)O2)O1

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found in taxon

Asimina triloba

1 reference

stated in

Additional bioactive compounds and trilobacin, a novel highly cytotoxic acetogenin, from the bark of Asimina triloba

Identifiers

InChI

InChI=1S/C37H66O7/c1-3-4-5-6-7-11-14-17-20-31(39)33-22-24-35(43-33)36-25-23-34(44-36)32(40)21-18-15-12-9-8-10-13-16-19-30-27-29(26-28(2)38)37(41)42-30/h29-36,39-40H,3-27H2,1-2H3/t29?,30-,31+,32-,33-,34-,35+,36+/m0/s1

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InChIKey

KGGVWMAPBXIMEM-YPSBWLOUSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KGGVWMAPBXIMEM-YPSBWLOUSA-N

1 reference

(Q105140769)

(5S)-5-[(11S)-11-hydroxy-11-[(2S,5R)-5-[(2R,5S)-5-[(1R)-1-hydroxyundecyl]oxolan-2-yl]oxolan-2-yl]undecyl]-3-(2-oxopropyl)oxolan-2-one

Statements

Identifiers

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