| SpectraBase Compound ID | DzehVSNECnl |
|---|---|
| InChI | InChI=1S/C45H72O12/c1-12-33-41-29(7)34(56-45(33)36(47)22-27(5)35(57-45)23-28(6)46)20-18-24(2)16-14-13-15-17-26(4)42(52)44(11,54)43(53)32(10)40(51)31(9)39(50)30(8)38(49)25(3)19-21-37(48)55-41/h13-16,19,21,24-35,38,40-42,46,49,51-52,54H,12,17-18,20,22-23H2,1-11H3/b15-13+,16-14+,21-19+ |
| InChIKey | VPNOAIHQOYAYGS-VZZMMMTHSA-N |
| Mol Weight | 805.1 g/mol |
| Molecular Formula | C45H72O12 |
| Exact Mass | 804.502378 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5Oz9r0YDOvb |
|---|---|
| Name | 41-DEMETHYL-HOMOOLIGOMYCIN-B |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H72O12 |
| InChI | InChI=1S/C45H72O12/c1-12-33-41-29(7)34(56-45(33)36(47)22-27(5)35(57-45)23-28(6)46)20-18-24(2)16-14-13-15-17-26(4)42(52)44(11,54)43(53)32(10)40(51)31(9)39(50)30(8)38(49)25(3)19-21-37(48)55-41/h13-16,19,21,24-35,38,40-42,46,49,51-52,54H,12,17-18,20,22-23H2,1-11H3/b15-13+,16-14+,21-19+ |
| InChIKey | VPNOAIHQOYAYGS-VZZMMMTHSA-N |
| Literature Reference Author | H.S.KIM,S.B.HAN,H.M.KIM,Y.H.KIM,J.J.LEE |
| Literature Reference Citation | J.ANTIBIOTICS,49,1275(1996) |
| Literature Reference DOI | 10.7164/antibiotics.49.1275 |
| Molecular Weight | 805.059 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMP10 |