| SpectraBase Spectrum ID |
LLnCGkZaGxA |
| Name |
Wilfordinine C |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H49NO19 |
| InChI |
InChI=1S/C43H49NO19/c1-20-27-15-16-44-17-28(27)37(51)56-18-39(7)29-30(57-22(3)46)34(60-25(6)49)42(19-55-21(2)45)35(61-36(50)26-13-11-10-12-14-26)31(58-23(4)47)33(62-38(52)40(20,8)53)41(9,54)43(42,63-39)32(29)59-24(5)48/h10-17,20,29-35,53-54H,18-19H2,1-9H3/t20?,29-,30-,31+,32-,33+,34-,35+,39+,40?,41+,42-,43+/m1/s1 |
| InChIKey |
XTKWHABDRIDBLJ-SWFKUUAOSA-N |
| Molecular Weight |
883.853 g/mol |
| SMILES |
O[C@]1([C@]2(OC(C(C(c3c(C(OC[C@]4([C@@]5([C@]([C@]([C@@]([C@@]1([C@@]5(OC(=O)C)[H])O4)([C@@](OC(=O)c1ccccc1)([C@]2(OC(=O)C)[H])[H])COC(=O)C)(OC(=O)C)[H])(OC(=O)C)[H])[H])C)=O)cncc3)C)(O)C)=O)[H])C |
| SPLASH |
splash10-053r-1910000080-cddc628b52aebbd47a9f |
| Source of Spectrum |
G4-63-361-5 |
| Synonyms |
(1S,3R,17S,18R,19R,20R,21S,22R,23R,24R,25S)-18,21,22,24-tetrakis(acetyloxy)-20-[(acetyloxy)methyl]-14,25-dihydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-9-azapentacyclo[15.7.1.0(1,20).0(3,23).0(7,12)]pentacosa-7(12),8,10-trien-19-yl benzoate |
| Wiley ID |
1608303 |
