| SpectraBase Compound ID | 1bfmNDR2Umr |
|---|---|
| InChI | InChI=1S/C69H102N20O20/c1-8-35(5)55(67(107)88-56(68(108)109)36(6)9-2)86-50(94)27-47-59(99)76-30-52(96)80-44(24-38-14-11-10-12-15-38)58(98)75-29-51(95)79-43(21-22-49(70)93)61(101)83-46(26-40-28-73-33-78-40)62(102)85-48(32-90)64(104)81-42(16-13-23-74-69(71)72)60(100)82-45(25-39-17-19-41(92)20-18-39)63(103)89-57(37(7)91)65(105)77-31-53(97)87-54(34(3)4)66(106)84-47/h10-12,14-15,17-20,28,33-37,42-48,54-57,90-92H,8-9,13,16,21-27,29-32H2,1-7H3,(H2,70,93)(H,73,78)(H,75,98)(H,76,99)(H,77,105)(H,79,95)(H,80,96)(H,81,104)(H,82,100)(H,83,101)(H,84,106)(H,85,102)(H,86,94)(H,87,97)(H,88,107)(H,89,103)(H,108,109)(H4,71,72,74) |
| InChIKey | CCZHUANHGGOQQY-UHFFFAOYSA-N |
| Mol Weight | 1531.7 g/mol |
| Molecular Formula | C69H102N20O20 |
| Exact Mass | 1530.757926 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JADZOE8cuPj |
|---|---|
| Name | SCH_486058 |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C69H102N20O20 |
| InChI | InChI=1S/C69H102N20O20/c1-8-35(5)55(67(107)88-56(68(108)109)36(6)9-2)86-50(94)27-47-59(99)76-30-52(96)80-44(24-38-14-11-10-12-15-38)58(98)75-29-51(95)79-43(21-22-49(70)93)61(101)83-46(26-40-28-73-33-78-40)62(102)85-48(32-90)64(104)81-42(16-13-23-74-69(71)72)60(100)82-45(25-39-17-19-41(92)20-18-39)63(103)89-57(37(7)91)65(105)77-31-53(97)87-54(34(3)4)66(106)84-47/h10-12,14-15,17-20,28,33-37,42-48,54-57,90-92H,8-9,13,16,21-27,29-32H2,1-7H3,(H2,70,93)(H,73,78)(H,75,98)(H,76,99)(H,77,105)(H,79,95)(H,80,96)(H,81,104)(H,82,100)(H,83,101)(H,84,106)(H,85,102)(H,86,94)(H,87,97)(H,88,107)(H,89,103)(H,108,109)(H4,71,72,74) |
| InChIKey | CCZHUANHGGOQQY-UHFFFAOYSA-N |
| Literature Reference Author | M.S.PUAR,T.M.CHAN,D.DELGARNO,E.BARRABEE,M.HALLADE,P.DAS,.PBA RTNER,Y.H.LIU,Y.H.IN |
| Literature Reference Citation | J.ANTIBIOTICS,58,151(2005) |
| Literature Reference DOI | 10.1038/ja.2005.18 |
| Molecular Weight | 1531.691 g/mol |
| Sample ID | 63 |
| Solvent | CD3OD |