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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H26O2
Molecular Weight 298.4192
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2,3,4,4A,5,6,11,12,12A-DECAHYDRO-8-METHOXY-12A-METHYL-1-CHRYSENOL

SMILES

COC1=CC2=C(C=C1)C3=C(CC2)[C@@H]4CCC[C@H](O)[C@@]4(C)CC3

InChI

InChIKey=NVNOGUBWHDSNGO-UFYCRDLUSA-N
InChI=1S/C20H26O2/c1-20-11-10-16-15-9-7-14(22-2)12-13(15)6-8-17(16)18(20)4-3-5-19(20)21/h7,9,12,18-19,21H,3-6,8,10-11H2,1-2H3/t18-,19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H26O2
Molecular Weight 298.4192
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 21:42:04 GMT 2025
Edited
by admin
on Mon Mar 31 21:42:04 GMT 2025
Record UNII
N449506EYR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-78045
Preferred Name English
1,2,3,4,4A,5,6,11,12,12A-DECAHYDRO-8-METHOXY-12A-METHYL-1-CHRYSENOL
Common Name English
D-HOMOESTRA-1,3,5(10),8-TETRAEN-17A.BETA.-OL, 3-METHOXY-
Common Name English
D-HOMOESTRA-1,3,5(10),8-TETRAEN-17A-OL, 3-METHOXY-, (17A.BETA.)-
Common Name English
1-CHRYSENOL, 1,2,3,4,4A,5,6,11,12,12A-DECAHYDRO-8-METHOXY-12A-METHYL-, (1S,4AS,12AS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
254189
Created by admin on Mon Mar 31 21:42:04 GMT 2025 , Edited by admin on Mon Mar 31 21:42:04 GMT 2025
PRIMARY
CAS
19882-46-3
Created by admin on Mon Mar 31 21:42:04 GMT 2025 , Edited by admin on Mon Mar 31 21:42:04 GMT 2025
PRIMARY
FDA UNII
N449506EYR
Created by admin on Mon Mar 31 21:42:04 GMT 2025 , Edited by admin on Mon Mar 31 21:42:04 GMT 2025
PRIMARY
NSC
78045
Created by admin on Mon Mar 31 21:42:04 GMT 2025 , Edited by admin on Mon Mar 31 21:42:04 GMT 2025
PRIMARY
EPA CompTox
DTXSID90941736
Created by admin on Mon Mar 31 21:42:04 GMT 2025 , Edited by admin on Mon Mar 31 21:42:04 GMT 2025
PRIMARY