| SpectraBase Compound ID | EQdGqnvsEN1 |
|---|---|
| InChI | InChI=1S/C54H84O21/c1-23-34(58)27(57)18-33(68-23)71-32-20-49(3,4)19-26-25-10-11-30-51(6)14-13-31(52(7,22-56)29(51)12-15-54(30,9)53(25,8)17-16-50(26,32)5)72-48-44(40(64)39(63)42(73-48)45(66)67)75-47-43(38(62)36(60)28(21-55)70-47)74-46-41(65)37(61)35(59)24(2)69-46/h10,24,26,28-33,35-44,46-48,55-56,58-65H,11-22H2,1-9H3,(H,66,67)/t24-,26?,28+,29?,30?,31-,32+,33?,35-,36-,37+,38-,39-,40-,41+,42?,43+,44+,46-,47?,48+,50+,51-,52+,53+,54+/m1/s1 |
| InChIKey | ONAAMCDHQSWPDU-ZVWLMZFASA-N |
| Mol Weight | 1069.2 g/mol |
| Molecular Formula | C54H84O21 |
| Exact Mass | 1068.55051 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AOHhq5B8a0u |
|---|---|
| Name | CHROMOSAPONIN 1 |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C54H84O21 |
| InChI | InChI=1S/C54H84O21/c1-23-34(58)27(57)18-33(68-23)71-32-20-49(3,4)19-26-25-10-11-30-51(6)14-13-31(52(7,22-56)29(51)12-15-54(30,9)53(25,8)17-16-50(26,32)5)72-48-44(40(64)39(63)42(73-48)45(66)67)75-47-43(38(62)36(60)28(21-55)70-47)74-46-41(65)37(61)35(59)24(2)69-46/h10,24,26,28-33,35-44,46-48,55-56,58-65H,11-22H2,1-9H3,(H,66,67)/t24-,26?,28+,29?,30?,31-,32+,33?,35-,36-,37+,38-,39-,40-,41+,42?,43+,44+,46-,47?,48+,50+,51-,52+,53+,54+/m1/s1 |
| InChIKey | ONAAMCDHQSWPDU-ZVWLMZFASA-N |
| NMR Standard | TMS |
| Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |