| SpectraBase Spectrum ID |
AHDYMN22DFF |
| Name |
Milbemycin B, 2,5,6,7-tetradehydro-4,28-dideoxy-25-methyl-, (25R)- |
| CAS Registry Number |
101977-94-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H44O5 |
| InChI |
InChI=1S/C32H44O5/c1-20-9-8-10-23(4)28-18-30(34-7)24(5)16-29(28)31(33)35-27-17-26(12-11-21(2)15-20)37-32(19-27)14-13-22(3)25(6)36-32/h8-11,16,18,20,22,25-27H,12-15,17,19H2,1-7H3/b9-8+,21-11+,23-10+/t20-,22-,25?,26+,27-,32-/m0/s1 |
| InChIKey |
OWCTWYLPWFDJGM-BDTOLVSVSA-N |
| Molecular Weight |
508.699 g/mol |
| SMILES |
[C@]12(OC([C@@](C)(CC2)[H])C)C[C@]2(OC(c3c(cc(OC)c(c3)C)\C(=C\C=C\[C@@](C\C(=C\C[C@](C2)(O1)[H])C)(C)[H])C)=O)[H] |
| SPLASH |
splash10-0uyi-4930000000-b028ba2ea7b36d75a033 |
| Source of Spectrum |
KC-1987-2178-30 |
| Synonyms |
Spiro[3,7-methano-1H,5H-2,6-benzodioxacyclooctadecin-5,2'-[2H]pyran], milbemycin B deriv.
(+)-Milbemycin B(3) methyl ether
(1'S,2R,5S,10'E,12'E,14'R,16'E,19'R)-7'-methoxy-5,6,6',10',14',16'-hexamethyl-2',20'-dioxaspiro[oxane-2,21'-tricyclo[17.3.1.0(4,9)]tricosane]-4'(9'),5',7',10',12',16'-hexaen-3'-one |
| Wiley ID |
1400244 |
