 Home > Encyclopedia > 16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione

16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione

16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione structure

CAS No:
94591-68-1
Formula:
C28H34N2O9
Chemical Name:
16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione
Synonyms:
thymidine-8-methoxypsoralen tetramethylethylene diadduct;TMPTE;TMPTE;94591-68-1;Thymidine-8-methoxypsoralen tetramethylethylene diadduct;DTXSID10915434;2H-Cyclobuta(4'',5'')pyrano(3'',2'':5',6')benzofuro(3',2':3,4)cyclobuta(1,2-d)pyrimidine-3,8,10(1H,6aH,9H)-trione, 7-(2-deoxy-beta-D-erythro-pentofuranosyl)-2a,6b,7,10a,10b,11b-hexahydro-5-methoxy-1,1,2,2,10a-pentamethyl-, (2S-(2alpha,5alpha,6beta(S*)))-;7-(2-Deoxypentofuranosyl)-10-hydroxy-5-methoxy-1,1,2,2,10a-pentamethyl-2a,6b,7,10a,10b,11b-hexahydro-2H-cyclobuta[4'',5'']pyrano[3'',2'':5',6'][1]benzofuro[3',2':3,4]cyclobuta[1,2-d]pyrimidine-3,8(1H,

Request for Quotation

16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione Basic Attributes

Molecular Weight：

542.6 g/mol

Exact Mass：

542.22643067 g/mol

Characteristics

PSA：

144 Å²

Drug Information

MeSH Entry Terms：

thymidine-8-methoxypsoralen tetramethylethylene diadduct

Computed Properties

Molecular Weight:542.6
XLogP3:2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:542.22643067
Monoisotopic Mass:542.22643067
Topological Polar Surface Area:144
Heavy Atom Count:39
Complexity:1130
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: sulfuryl fluoride; dichloromethane boiling point; 2-pentanol; viprostol; 2-chlorobutane; sofosbuvir velpatasvir

Guide of 16-[(4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-11-methoxy-5,5,6,6,20-pentamethyl-9,13-dioxa-16,18-diazahexacyclo[10.9.0.03,10.04,7.014,21.015,20]henicosa-1,3(10),11-triene-8,17,19-trione

Basic Attributes
Characteristics
Drug Information
Computed Properties

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