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Details

Stereochemistry ABSOLUTE
Molecular Formula C40H60O13
Molecular Weight 748.8966
Optical Activity UNSPECIFIED
Defined Stereocenters 18 / 18
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ER-811475

SMILES

CO[C@H]1[C@@H](C[C@H](O)CO)O[C@H]2C[C@H]3O[C@H](C[C@@H](C)C3=C)CC[C@@H]4O[C@H](CC4=C)CCC(=O)C[C@H]5O[C@@H]6[C@@H](O[C@H]7CC[C@H](CC(=O)C[C@H]12)O[C@@H]7[C@@H]6O)[C@H]5O

InChI

InChIKey=DRIHUUFRFITXNV-XXZFRVJGSA-N
InChI=1S/C40H60O13/c1-19-11-26-7-9-29-20(2)12-25(48-29)6-5-22(42)15-33-35(45)39-40(53-33)36(46)38-30(52-39)10-8-27(50-38)13-23(43)14-28-32(17-31(49-26)21(19)3)51-34(37(28)47-4)16-24(44)18-41/h19,24-41,44-46H,2-3,5-18H2,1,4H3/t19-,24+,25+,26+,27-,28+,29+,30+,31-,32+,33-,34-,35+,36+,37-,38+,39+,40+/m1/s1

HIDE SMILES / InChI

Molecular Formula C40H60O13
Molecular Weight 748.8966
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 18 / 18
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
8426RBM6V9
Record Status Validated (UNII)
Record Version