| SpectraBase Compound ID | F11IyZ0Y522 |
|---|---|
| InChI | InChI=1S/C62H108O24/c1-10-12-14-15-16-17-20-23-27-31-40(63)80-50-36(7)76-59(48(71)46(50)69)83-52-38(9)78-62(56(82-57(73)33(3)4)55(52)86-58-47(70)44(67)42(65)34(5)74-58)84-51-37(8)77-60-49(72)53(51)81-41(64)32-28-24-21-18-19-22-26-30-39(29-25-13-11-2)79-61-54(85-60)45(68)43(66)35(6)75-61/h33-39,42-56,58-62,65-72H,10-32H2,1-9H3/t34-,35+,36-,37-,38-,39-,42-,43-,44+,45-,46-,47+,48+,49+,50-,51-,52-,53-,54+,55+,56+,58-,59-,60-,61-,62-/m0/s1 |
| InChIKey | UHINHOUYEHFJGW-JYPGLRBKSA-N |
| Mol Weight | 1237.5 g/mol |
| Molecular Formula | C62H108O24 |
| Exact Mass | 1236.723054 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KtTzT3j4IWJ |
|---|---|
| Name | PESCAPREIN_VIII |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C62H108O24 |
| InChI | InChI=1S/C62H108O24/c1-10-12-14-15-16-17-20-23-27-31-40(63)80-50-36(7)76-59(48(71)46(50)69)83-52-38(9)78-62(56(82-57(73)33(3)4)55(52)86-58-47(70)44(67)42(65)34(5)74-58)84-51-37(8)77-60-49(72)53(51)81-41(64)32-28-24-21-18-19-22-26-30-39(29-25-13-11-2)79-61-54(85-60)45(68)43(66)35(6)75-61/h33-39,42-56,58-62,65-72H,10-32H2,1-9H3/t34-,35+,36-,37-,38-,39-,42-,43-,44+,45-,46-,47+,48+,49+,50-,51-,52-,53-,54+,55+,56+,58-,59-,60-,61-,62-/m0/s1 |
| InChIKey | UHINHOUYEHFJGW-JYPGLRBKSA-N |
| Literature Reference Author | C.ESCOBEDO-MARTINEZ,R.PEREDA-MIRANDA |
| Literature Reference Citation | J.NAT.PROD.,70,974(2007) |
| Literature Reference DOI | 10.1021/np070040h |
| Molecular Weight | 1237.525 g/mol |
| Sample ID | 30499 |
| Solvent | C5D5N |