| SpectraBase Compound ID | JZRQYzu7RO6 |
|---|---|
| InChI | InChI=1S/C54H88O23/c1-23-32(59)42(76-45-40(67)37(64)34(61)25(19-56)72-45)43(77-46-41(68)38(65)35(62)26(20-57)73-46)47(70-23)74-30-10-11-49(4)27(50(30,5)21-58)8-12-51(6)28(49)9-13-54-29-16-48(2,3)14-15-53(29,22-69-54)31(17-52(51,54)7)75-44-39(66)36(63)33(60)24(18-55)71-44/h9,13,23-47,55-68H,8,10-12,14-22H2,1-7H3/t23-,24-,25-,26-,27?,28?,29?,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43-,44+,45+,46+,47+,49+,50+,51-,52+,53-,54+/m0/s1 |
| InChIKey | MHHVKMAUXMWTDS-IPMXRGTMSA-N |
| Mol Weight | 1105.3 g/mol |
| Molecular Formula | C54H88O23 |
| Exact Mass | 1104.571639 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GeAfpSN6361 |
|---|---|
| Name | CLINOPOSAPONIN VIII |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C54H88O23 |
| InChI | InChI=1S/C54H88O23/c1-23-32(59)42(76-45-40(67)37(64)34(61)25(19-56)72-45)43(77-46-41(68)38(65)35(62)26(20-57)73-46)47(70-23)74-30-10-11-49(4)27(50(30,5)21-58)8-12-51(6)28(49)9-13-54-29-16-48(2,3)14-15-53(29,22-69-54)31(17-52(51,54)7)75-44-39(66)36(63)33(60)24(18-55)71-44/h9,13,23-47,55-68H,8,10-12,14-22H2,1-7H3/t23-,24-,25-,26-,27?,28?,29?,30+,31+,32+,33-,34-,35-,36+,37+,38+,39-,40-,41-,42+,43-,44+,45+,46+,47+,49+,50+,51-,52+,53-,54+/m0/s1 |
| InChIKey | MHHVKMAUXMWTDS-IPMXRGTMSA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |