Name: Name:N-Desacetyl-N-forMyl Thiocolchicoside
Brand: Angene
SKU: AG00C2ZK
Rating: 90 (10 reviews)

N-Desacetyl-N-forMyl Thiocolchicoside

CAS No.:

219547-29-2

Catalog Number:

AG00C2ZK

Molecular Formula:

Molecular Weight:

Catalog Number:

AG00C2ZK

Chemical Name:

N-Desacetyl-N-forMyl Thiocolchicoside

CAS Number:

219547-29-2

MDL Number:

MFCD24386546

IUPAC Name:

N-[(7S)-1,2-dimethoxy-10-methylsulfanyl-9-oxo-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-6,7-dihydro-5H-benzo[a]heptalen-7-yl]formamide

InChI:

InChI=1S/C26H31NO10S/c1-34-24-17(36-26-23(33)22(32)21(31)18(10-28)37-26)8-12-4-6-15(27-11-29)14-9-16(30)19(38-3)7-5-13(14)20(12)25(24)35-2/h5,7-9,11,15,18,21-23,26,28,31-33H,4,6,10H2,1-3H3,(H,27,29)/t15-,18+,21+,22-,23+,26+/m0/s1

InChI Key:

HBTNEQNKAJFDDC-MSNGREAPSA-N

Complexity:

970

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

549.167g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

549.591g/mol

Monoisotopic Mass:

549.167g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

189A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.4