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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H29NO
Molecular Weight 287.4397
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of GEPHYROTOXIN

SMILES

[H][C@@]12CC[C@H](CCO)N1[C@@]3([H])CCC[C@H](C\C=C/C#C)[C@@]3([H])CC2

InChI

InChIKey=IQTIQAXNJBRKRG-IZDLKJCPSA-N
InChI=1S/C19H29NO/c1-2-3-4-6-15-7-5-8-19-18(15)12-11-16-9-10-17(13-14-21)20(16)19/h1,3-4,15-19,21H,5-14H2/b4-3-/t15-,16-,17+,18+,19-/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H29NO
Molecular Weight 287.4397
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
01N796R81A
Record Status Validated (UNII)
Record Version