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Vinmegallate-d9 , CAS No.83482-77-3(unlabeled)
Basic Description
Synonyms | Vinmegallate | 83482-77-3 | Vinmegallate [INN] | UNII-Q50MB6G17M | Q50MB6G17M | [(15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),13,16-hexaen-17-yl]methyl 3,4,5-trimethoxybenzoate | 17,18-Didehydro-3alpha,16alpha-eburnamenine-14-m |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | [(15S,19S)-15-ethyl-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2,4,6,8(18),13,16-hexaen-17-yl]methyl 3,4,5-trimethoxybenzoate |
INCHI | InChI=1S/C30H32N2O5/c1-5-30-12-8-13-31-14-11-22-21-9-6-7-10-23(21)32(26(22)28(30)31)20(17-30)18-37-29(33)19-15-24(34-2)27(36-4)25(16-19)35-3/h6-10,12,15-17,28H,5,11,13-14,18H2,1-4H3/t28-,30+/m1/s1 |
InChi Key | YBXKKOCGWBHEBM-DGPALRBDSA-N |
Canonical SMILES | CCC12C=CCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=C2)COC(=O)C6=CC(=C(C(=C6)OC)OC)OC |
Isomeric SMILES | CC[C@@]12C=CCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4C(=C2)COC(=O)C6=CC(=C(C(=C6)OC)OC)OC |
PubChem CID | 3086161 |
Molecular Weight | 509.64 |
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