SpectraBase Spectrum ID |
KXrZhzgoKDy |
Name |
(-)-Neopodophllotoxin |
CAS Registry Number |
1456-54-8 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H22O8 |
InChI |
InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(29-9-28-14)7-12(11)20-13(8-23)19(18)22(24)30-20/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20+/m0/s1 |
InChIKey |
IXIUIXFHMVRZSY-LGWHJFRWSA-N |
Molecular Weight |
414.410 g/mol |
SMILES |
OC[C@]1([C@]2([C@](c3cc(OC)c(c(c3)OC)OC)(c3c([C@]1(OC2=O)[H])cc1c(OCO1)c3)[H])[H])[H] |
SPLASH |
splash10-014i-9004400000-ea24b01ed2728774c70a |
Source of Spectrum |
J-57-1516-0 |
Synonyms |
(-)-Neopophllotoxin
(1S,11R,12R,15R)-15-(hydroxymethyl)-11-(3,4,5-trimethoxyphenyl)-5,7,14-trioxatetracyclo[10.2.1.0(2,10).0(4,8)]pentadeca-2(10),3,8-trien-13-one |
Wiley ID |
1375348 |