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Details

Stereochemistry ABSOLUTE
Molecular Formula C34H51N5O7
Molecular Weight 643.8104
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Vodudeutentan

SMILES

[2H]C[C@H]1CCC[C@@H](C[2H])N1C(=O)N[C@@H](CC(C)(C)C)C(=O)N[C@H](CC2=CN(C(=O)OC)C3=C2C=CC=C3)C(=O)N[C@H](CCCC)C(O)=O

InChI

InChIKey=LPAHKJMGDSJDRG-ZEYDBOQPSA-N
InChI=1S/C34H51N5O7/c1-8-9-16-25(31(42)43)35-29(40)26(18-23-20-38(33(45)46-7)28-17-11-10-15-24(23)28)36-30(41)27(19-34(4,5)6)37-32(44)39-21(2)13-12-14-22(39)3/h10-11,15,17,20-22,25-27H,8-9,12-14,16,18-19H2,1-7H3,(H,35,40)(H,36,41)(H,37,44)(H,42,43)/t21-,22+,25-,26-,27+/m1/s1/i2D,3D

HIDE SMILES / InChI

Molecular Formula C34H51N5O7
Molecular Weight 643.8104
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
2YCH69X4OX
Record Status Validated (UNII)
Record Version