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Methyl (1S,17S)-17-(beta-L-Glucopyranosyloxy)-18,23-Dioxa-3,13-Diazahexacyclo[13.7.1.01,13.02,10.04,9.016,21]Tricosa-2(10),4,6,8,19-Pentaene-20-Carboxylate
[CAS# 54422-49-0]

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CAS#: 54422-49-0
Product: Methyl (1S,17S)-17-(beta-L-Glucopyranosyloxy)-18,23-Dioxa-3,13-Diazahexacyclo[13.7.1.01,13.02,10.04,9.016,21]Tricosa-2(10),4,6,8,19-Pentaene-20-Carboxylate
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Identification
Name Methyl (1S,17S)-17-(beta-L-Glucopyranosyloxy)-18,23-Dioxa-3,13-Diazahexacyclo[13.7.1.01,13.02,10.04,9.016,21]Tricosa-2(10),4,6,8,19-Pentaene-20-Carboxylate
Synonyms Cadambine; D-Homooxayohimban-16-carboxylic acid, 16,17-didehydro-3,21-epoxy-19-(β-D-glucopyranosyloxy)-, methyl ester, (3β,19α,20α,21β)-
Molecular Structure CAS#: 54422-49-0, Methyl (1S,17S)-17-(beta-L-Glucopyranosyloxy)-18,23-Dioxa-3,13-Diazahexacyclo[13.7.1.0<Sup>1,13</Sup>.0<Sup>2,10</Sup>.0<Sup>4,9</Sup>.0<Sup>16,21</Sup>]Tricosa-2(10),4,6,8,19-Pentaene-20-Carboxylate
Molecular Formula C27H32N2O10
Molecular Weight 544.55
CAS Registry Number 54422-49-0
SMILES O=C(OC)\C6=C\O[C@@H](O[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)CO)C7C4O[C@]5(c3c(c2ccccc2n3)CCN5C4)CC67
InChI 1S/C27H32N2O10/c1-35-24(34)15-11-36-25(38-26-22(33)21(32)20(31)18(10-30)37-26)19-14(15)8-27-23-13(6-7-29(27)9-17(19)39-27)12-4-2-3-5-16(12)28-23/h2-5,11,14,17-22,25-26,28,30-33H,6-10H2,1H3/t14?,17?,18-,19?,20-,21+,22-,25-,26+,27-/m0/s1
InChIKey OVRROYYXOBYCSR-VAYLOVGLSA-N
Properties
Density 1.602g/cm3 (Cal.)
Boiling point 795.738°C at 760 mmHg (Cal.)
Flash point 435.047°C (Cal.)
Market Analysis Reports
List of Reports Available for Methyl (1S,17S)-17-(beta-L-Glucopyranosyloxy)-18,23-Dioxa-3,13-Diazahexacyclo[13.7.1.01,13.02,10.04,9.016,21]Tricosa-2(10),4,6,8,19-Pentaene-20-Carboxylate
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