 Home > Encyclopedia > 1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate structure

CAS No:
23509-22-0
Formula:
C33H46N2O6
Chemical Name:
1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate
Synonyms:
23509-22-0;BRN 1613496;DTXSID60946197;BATRACHOTOXININ A, 20-alpha-(2,4-DIMETHYL-5-ETHYL-1H-PYRROLE-3-CARBOXYLATE);1-(9,12-Dihydroxy-2,11a-dimethyl-1,2,3,4,7a,8,9,10,11,11a,12,13-dodecahydro-7H-9,11b-epoxy-13a,5a-prop[1]enophenanthro[2,1-f][1,4]oxazepin-14-yl)ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

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1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Basic Attributes

Molecular Weight：

566.7 g/mol

Exact Mass：

566.33558719 g/mol

Characteristics

PSA：

104 Å²

Computed Properties

Molecular Weight:566.7
XLogP3:2.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:566.33558719
Monoisotopic Mass:566.33558719
Topological Polar Surface Area:104
Heavy Atom Count:41
Complexity:1190
Defined Atom Stereocenter Count:5
Undefined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-acetyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

23509-23-1

Hot Searches: tert-butanol; methanol formula; fusidic acid cream; oxychem; nitrogen trioxide; cefpodoxime proxetil

Guide of 1-[(1R,5R,6S,9S,12R)-9,12-dihydroxy-6,16-dimethyl-10,19-dioxa-16-azahexacyclo[12.5.3.15,9.01,14.02,11.06,11]tricosa-2,21-dien-22-yl]ethyl 5-ethyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

Basic Attributes
Characteristics
Computed Properties
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