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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H36O5
Molecular Weight 428.561
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETOMEPREGENOL

SMILES

[H][C@@]12CC[C@](OC(C)=O)(C(C)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])C=C(C)C4=C[C@H](CC[C@]34C)OC(C)=O

InChI

InChIKey=SDHHPVPFUVQWKY-AVHYYFBHSA-N
InChI=1S/C26H36O5/c1-15-13-20-21(24(5)10-7-19(14-23(15)24)30-17(3)28)8-11-25(6)22(20)9-12-26(25,16(2)27)31-18(4)29/h13-14,19-22H,7-12H2,1-6H3/t19-,20+,21-,22-,24+,25-,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H36O5
Molecular Weight 428.561
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
1JI0G99BDO
Record Status Validated (UNII)
Record Version