Analyte Name

2-(O-DMT)-6-(Cholest-5-en-3-ol (3beta)-3-carbamate)-1-hexanol

CAS Number

157774-66-8

Molecular Formula

C56H79NO7

Molecular Weight

862.24

Accurate Mass

862.59

SMILES

O=C(OC1CC2=CCC3C(CCC4(C)C(CCC34)C(C)CCCC(C)C)C2(C)CC1)NCCCCC(CO)COC(C=5C=CC=CC5)(C6=CC=C(OC)C=C6)C7=CC=C(OC)C=C8

InChI

InChI=1S/C56H79NO6/c1-39(2)14-13-15-40(3)50-29-30-51-49-28-23-45-36-48(31-33-54(45,4)52(49)32-34-55(50,51)5)63-53(59)57-35-12-11-16-41(37-58)38-62-56(42-17-9-8-10-18-42,43-19-24-46(60-6)25-20-43)44-21-26-47(61-7)27-22-44/h8-10,17-27,39-41,48-52,58H,11-16,28-38H2,1-7H3,(H,57,59)

IUPAC

10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl (6-(bis(4-methoxyphenyl)(phenyl)methoxy)-5-(hydroxymethyl)hexyl)carbamate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat