| SpectraBase Spectrum ID |
DVXwgQPcOkW |
| Name |
2H,16H-1,24-Etheno-6,10:11,15-dimethenopyrido[2',3':17,18]oxacycloei cosino[2,3,4-ij]isoquinoline, rodiasine deriv. |
| Alternate Name(s) |
Rodiasine, O7,O12'-diacetyl-O7-demethyl-15'-oxo-, (1'.alpha.)-
(1R,14S)-6-(acetyloxy)-9,20,25-trimethoxy-15,30-dimethyl-2-oxo-23-oxa-15,30-diazaheptacyclo[22.6.2.1(3,7).1(8,12).1(14,18).0(27,31).0(22,33)]pentatriaconta-3(35),4,6,8,10,12(34),18(33),19,21,24(32),25,27(31)-dodecaen-21-yl acetate
o,o-diacetyloxandrine
Oxandrine diacetate |
| CAS Registry Number |
104778-25-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C41H42N2O9 |
| InChI |
InChI=1S/C41H42N2O9/c1-22(44)50-33-11-9-27-18-30(33)29-16-24(8-10-32(29)47-5)17-31-37-26(13-14-42(31)3)20-36(49-7)40(51-23(2)45)41(37)52-35-21-28-25(19-34(35)48-6)12-15-43(4)38(28)39(27)46/h8-11,16,18-21,31,38H,12-15,17H2,1-7H3/t31-,38+/m0/s1 |
| InChIKey |
LUKQTTQMVAAFBI-VHRGECNRSA-N |
| Molecular Weight |
706.792 g/mol |
| SMILES |
c12c3[C@@](N(C)CCc3cc(c1OC(=O)C)OC)(Cc1cc(-c3c(OC(=O)C)ccc(C([C@]4(c5cc(O2)c(cc5CCN4C)OC)[H])=O)c3)c(cc1)OC)[H] |
| SPLASH |
splash10-0bt9-0100006900-8eece35ad70c9f74ccbc |
| Source of Spectrum |
X2-54-687-347 |
| Wiley ID |
1604164 |
![2H,16H-1,24-Etheno-6,10:11,15-dimethenopyrido[2',3':17,18]oxacycloei cosino[2,3,4-ij]isoquinoline, rodiasine deriv.](/api/spectrum/DVXwgQPcOkW/structure.png?h=300&w=458 "2H,16H-1,24-Etheno-6,10:11,15-dimethenopyrido[2',3':17,18]oxacycloei cosino[2,3,4-ij]isoquinoline, rodiasine deriv.")
