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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H42O4
Molecular Weight 430.62
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KRYPTOGENIN

SMILES

[H][C@@]12CC(=O)[C@]([H])([C@H](C)C(=O)CC[C@@H](C)CO)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CC=C4C[C@@H](O)CC[C@]34C

InChI

InChIKey=GDKGOXUWEBGZBY-WQTURIIHSA-N
InChI=1S/C27H42O4/c1-16(15-28)5-8-23(30)17(2)25-24(31)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-22,25,28-29H,5,7-15H2,1-4H3/t16-,17-,19+,20-,21+,22+,25+,26+,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H42O4
Molecular Weight 430.62
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:54 GMT 2023
Edited
by admin
on Sat Dec 16 08:57:54 GMT 2023
Record UNII
BXC9X8B37J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KRYPTOGENIN
Common Name English
CHOLEST-5-ENE-16,22-DIONE, 3,26-DIHYDROXY-, (3.BETA.,25R)-
Systematic Name English
(3.BETA.,25R)-3,26-DIHYDROXYCHOLEST-5-ENE-16,22-DIONE
Systematic Name English
CHOLEST-5-ENE-16,22-DIONE, 3.BETA.,26-DIHYDROXY-, (20S,25R)-
Systematic Name English
NSC-93751
Code English
CRYPTOGENIN
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80963669
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
PUBCHEM
21117640
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
CAS
468-99-5
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
NSC
93751
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY
FDA UNII
BXC9X8B37J
Created by admin on Sat Dec 16 08:57:54 GMT 2023 , Edited by admin on Sat Dec 16 08:57:54 GMT 2023
PRIMARY