| SpectraBase Spectrum ID |
HmIYiI8Hvay |
| Name |
24,25-Didehydro-25-deoxy-21,22-O-isopropyidene-sorangicin - allyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C53H72O10 |
| InChI |
InChI=1S/C53H72O10/c1-8-33-56-49(54)27-19-18-21-36(2)34-38(4)51-44-32-30-40(57-51)22-14-10-9-11-16-24-46-52(63-53(6,7)62-46)45-31-29-37(3)41(58-45)25-20-26-42-39(5)47-35-48(59-42)43(60-47)23-15-12-13-17-28-50(55)61-44/h8,10,12-17,20,23-24,26,28,34,36-37,39-48,51-52H,1,9,11,18-19,21-22,25,27,30,32-33,35H2,2-7H3/b13-12-,14-10+,23-15+,24-16+,26-20+,28-17-,38-34+/t36-,37-,39+,40+,41-,42+,43-,44?,45-,46+,47-,48-,51+,52-/m1/s1 |
| InChIKey |
DWTICDVIBBNHSX-HTANOCJGSA-N |
| Molecular Weight |
869.149 g/mol |
| SMILES |
[C@]12([C@]3(C#C[C@]([C@](O3)(C\C=C\[C@@]3(O[C@]4([C@@](\C=C\C=C/C=C\C(OC5CC[C@@](O[C@]5(\C(=C\[C@@](CCCCC(=O)OCC=C)(C)[H])C)[H])(C\C=C\CC\C=C\[C@@]1(OC(O2)(C)C)[H])[H])=O)(O[C@@]([C@]3(C)[H])(C4)[H])[H])[H])[H])[H])(C)[H])[H])[H] |
| SPLASH |
splash10-000b-9060000000-e13baf3757ff95cb5d6c |
| Source of Spectrum |
U-1993-301-16 |
| Synonyms |
Prop-2-en-1-yl (6R,7E)-6-methyl-8-[(1R,3E,7E,9S,13S,14R,17R,18R,20E,29E,31Z,33Z,38S)-11,11,17,42-tetramethyl-35-oxo-10,12,23,27,36,39,43-heptaoxahexacyclo[35.2.2.1(14,18).1(22,26).0(9,13).0(24,28)]tritetraconta-3,7,20,29,31,33-hexaen-15-yn-38-yl]non-7-enoate |
| Wiley ID |
764910 |
