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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H35NO5
Molecular Weight 441.5598
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SONGORINE DIACETATE

SMILES

[H][C@@]12C[C@]3([C@H](OC(C)=O)C1=C)[C@@]4([H])C[C@@]5([H])[C@@]6([C@H](CC[C@@]5(C)CN(CC)[C@]46[H])OC(C)=O)[C@]3([H])CC2=O

InChI

InChIKey=UWFHTWFQCDQGKI-UQLLBUQISA-N
InChI=1S/C26H35NO5/c1-6-27-12-24(5)8-7-21(31-14(3)28)26-19(24)9-17(22(26)27)25-11-16(18(30)10-20(25)26)13(2)23(25)32-15(4)29/h16-17,19-23H,2,6-12H2,1,3-5H3/t16-,17+,19-,20-,21+,22-,23-,24+,25+,26+/m1/s1

HIDE SMILES / InChI

Molecular Formula C26H35NO5
Molecular Weight 441.5598
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
3W2U2H8O5F
Record Status Validated (UNII)
Record Version