![DESACYL-CAMELLIASAPONIN_A;CAMELLIAGENIN_A_3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL](/api/spectrum/IIovklU3DsT/structure.png?h=300&w=458 "DESACYL-CAMELLIASAPONIN_A;CAMELLIAGENIN_A_3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL")
| SpectraBase Compound ID | 3roYUN6iamG |
|---|---|
| InChI | InChI=1S/C53H86O24/c1-48(2)14-22-21-8-9-27-50(5)12-11-30(49(3,4)26(50)10-13-51(27,6)52(21,7)16-29(59)53(22,20-56)28(58)15-48)73-47-42(77-45-37(66)35(64)33(62)25(18-55)72-45)39(38(67)40(75-47)43(68)69)74-46-41(31(60)23(57)19-70-46)76-44-36(65)34(63)32(61)24(17-54)71-44/h8,22-42,44-47,54-67H,9-20H2,1-7H3,(H,68,69)/t22-,23+,24-,25+,26?,27?,28-,29+,30-,31+,32-,33-,34+,35-,36-,37+,38+,39+,40+,41-,42-,44+,45-,46+,47-,50-,51+,52+,53+/m0/s1 |
| InChIKey | XVGHQYAPGZPITD-RNOBRCKISA-N |
| Mol Weight | 1107.2 g/mol |
| Molecular Formula | C53H86O24 |
| Exact Mass | 1106.550904 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IIovklU3DsT |
|---|---|
| Name | DESACYL-CAMELLIASAPONIN_A;CAMELLIAGENIN_A_3-O-[BETA-D-GALACTOPYRANOSYL-(1->2)]-[BETA-D-GLUCOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C53H86O24 |
| InChI | InChI=1S/C53H86O24/c1-48(2)14-22-21-8-9-27-50(5)12-11-30(49(3,4)26(50)10-13-51(27,6)52(21,7)16-29(59)53(22,20-56)28(58)15-48)73-47-42(77-45-37(66)35(64)33(62)25(18-55)72-45)39(38(67)40(75-47)43(68)69)74-46-41(31(60)23(57)19-70-46)76-44-36(65)34(63)32(61)24(17-54)71-44/h8,22-42,44-47,54-67H,9-20H2,1-7H3,(H,68,69)/t22-,23+,24-,25+,26?,27?,28-,29+,30-,31+,32-,33-,34+,35-,36-,37+,38+,39+,40+,41-,42-,44+,45-,46+,47-,50-,51+,52+,53+/m0/s1 |
| InChIKey | XVGHQYAPGZPITD-RNOBRCKISA-N |
| Literature Reference Author | M.YOSHIKAWA,T.MURAKAMI,S.YOSHIZUMI,N.MURAKAMI,J.YAMAHARA,H.M ATSUDA |
| Literature Reference Citation | CHEM.PHARM.BULL.,44,1899(1996) |
| Literature Reference DOI | 10.1248/cpb.44.1899 |
| Molecular Weight | 1107.251 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMZ19579 |