U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C33H46N4O6
Molecular Weight 594.7415
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of STERCOBILIN

SMILES

CC[C@H]1[C@H](CC2=C(C)C(CCC(O)=O)=C(N2)\C=C3/N=C(C[C@@H]4NC(=O)[C@H](CC)[C@H]4C)C(C)=C3CCC(O)=O)NC(=O)[C@@H]1C

InChI

InChIKey=DEEUSUJLZQQESV-BQUSTMGCSA-N
InChI=1S/C33H46N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h15-16,19-21,26-27,35H,7-14H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b28-15-/t16-,19-,20-,21-,26+,27+/m1/s1

HIDE SMILES / InChI

Molecular Formula C33H46N4O6
Molecular Weight 594.7415
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 08:58:21 GMT 2023
Edited
by admin
on Sat Dec 16 08:58:21 GMT 2023
Record UNII
17G380DO11
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
STERCOBILIN
MI  
Common Name English
STERCOBILIN IX.ALPHA.
Common Name English
21H-BILINE-8,12-DIPROPANOIC ACID, 3,18-DIETHYL-1,2,3,4,5,15,16,17,18,19,22,24-DODECAHYDRO-2,7,13,17-TETRAMETHYL-1,19-DIOXO-, (2R,3R,4S,16S,17R,18R)-
Systematic Name English
(-)-STERCOBILIN
Common Name English
L-STERCOBILIN
Common Name English
STERCOBILIN [MI]
Common Name English
BILINE-8,12-DIPROPIONIC ACID, 3,18-DIETHYL-1,2,3,4,5,15,16,17,18,19,22,24-DODECAHYDRO-2,7,13,17-TETRAMETHYL-1,19-DIOXO-, (-)-
Systematic Name English
STERCOBILINE
Common Name English
Classification Tree Code System Code
LOINC 2969-4
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
Code System Code Type Description
ECHA (EC/EINECS)
251-887-8
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
WIKIPEDIA
Stercobilin
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
CAS
34217-90-8
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
MERCK INDEX
m11338
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY Merck Index
CHEBI
29023
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID00885576
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
PUBCHEM
44457542
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
CHEBI
26756
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY
FDA UNII
17G380DO11
Created by admin on Sat Dec 16 08:58:22 GMT 2023 , Edited by admin on Sat Dec 16 08:58:22 GMT 2023
PRIMARY