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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H35N3O3
Molecular Weight 437.5744
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of (4.ALPHA.)-13-METHYL-16-(2-(3-PYRIDINYLCARBONYL)HYDRAZINYLIDENE)-17-NORKAURAN-18-OIC ACID

SMILES

[H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=O)C4=CC=CN=C4)CC[C@]5([H])[C@@](C)(CCC[C@@]25C)C(O)=O

InChI

InChIKey=XTBFTBWACHIIEB-CAXRXNNBSA-N
InChI=1S/C26H35N3O3/c1-23-11-7-19-24(2)9-5-10-25(3,22(31)32)18(24)8-12-26(19,16-23)14-20(23)28-29-21(30)17-6-4-13-27-15-17/h4,6,13,15,18-19H,5,7-12,14,16H2,1-3H3,(H,29,30)(H,31,32)/b28-20+/t18-,19-,23-,24+,25+,26-/m0/s1

HIDE SMILES / InChI

Molecular Formula C26H35N3O3
Molecular Weight 437.5744
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:16:12 GMT 2023
Edited
by admin
on Sat Dec 16 08:16:12 GMT 2023
Record UNII
JHB4SG2DJL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(4.ALPHA.)-13-METHYL-16-(2-(3-PYRIDINYLCARBONYL)HYDRAZINYLIDENE)-17-NORKAURAN-18-OIC ACID
Systematic Name English
17-NORKAURAN-18-OIC ACID, 13-METHYL-16-(2-(3-PYRIDINYLCARBONYL)HYDRAZINYLIDENE)-, (4.ALPHA.)-
Systematic Name English
16-(3-PYRIDINOYLHYDRAZONO)-ENT-BEYERAN-19-OIC ACID
Common Name English
Code System Code Type Description
PUBCHEM
54672346
Created by admin on Sat Dec 16 08:16:12 GMT 2023 , Edited by admin on Sat Dec 16 08:16:12 GMT 2023
PRIMARY
CAS
1334421-48-5
Created by admin on Sat Dec 16 08:16:12 GMT 2023 , Edited by admin on Sat Dec 16 08:16:12 GMT 2023
PRIMARY
FDA UNII
JHB4SG2DJL
Created by admin on Sat Dec 16 08:16:12 GMT 2023 , Edited by admin on Sat Dec 16 08:16:12 GMT 2023
PRIMARY
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