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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H40O3
Molecular Weight 412.6047
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of SARGACHROMANOL C

SMILES

CC(C)=CC[C@@H](O)C(\C)=C\CC\C(C)=C\CC[C@]1(C)CCC2=C(O1)C(C)=CC(O)=C2

InChI

InChIKey=RFIIOYJLKCYOCK-PUMPRSRSSA-N
InChI=1S/C27H40O3/c1-19(2)12-13-25(29)21(4)11-7-9-20(3)10-8-15-27(6)16-14-23-18-24(28)17-22(5)26(23)30-27/h10-12,17-18,25,28-29H,7-9,13-16H2,1-6H3/b20-10+,21-11+/t25-,27-/m1/s1

HIDE SMILES / InChI

Molecular Formula C27H40O3
Molecular Weight 412.6047
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 2
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:42:12 GMT 2023
Edited
by admin
on Sat Dec 16 01:42:12 GMT 2023
Record UNII
73O50WVY91
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SARGACHROMANOL C
INCI  
INCI  
Official Name English
SARGACHROMANOL C, (+)-
Common Name English
SARGASOL C
Brand Name English
SARGACHROMANOL C [INCI]
Common Name English
2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2-((3E,7E,9R)-9-HYDROXY-4,8,12-TRIMETHYL-3,7,11-TRIDECATRIENYL)-2,8-DIMETHYL-, (2R)-
Systematic Name English
2H-1-BENZOPYRAN-6-OL, 3,4-DIHYDRO-2-((3E,7E,9R)-9-HYDROXY-4,8,12-TRIMETHYL-3,7,11-TRIDECATRIEN-1-YL)-2,8-DIMETHYL-, (2R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
11177417
Created by admin on Sat Dec 16 01:42:12 GMT 2023 , Edited by admin on Sat Dec 16 01:42:12 GMT 2023
PRIMARY
CAS
856414-52-3
Created by admin on Sat Dec 16 01:42:12 GMT 2023 , Edited by admin on Sat Dec 16 01:42:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID60234889
Created by admin on Sat Dec 16 01:42:12 GMT 2023 , Edited by admin on Sat Dec 16 01:42:12 GMT 2023
PRIMARY
FDA UNII
73O50WVY91
Created by admin on Sat Dec 16 01:42:12 GMT 2023 , Edited by admin on Sat Dec 16 01:42:12 GMT 2023
PRIMARY