![3-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(](/api/spectrum/DSVfNXz6Ahl/structure.png?h=300&w=458 "3-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL-(")
| SpectraBase Compound ID | Kil8xRhDKV4 |
|---|---|
| InChI | InChI=1S/C69H112O35/c1-25-36(77)39(80)42(83)56(94-25)99-48-33(76)21-91-55(45(48)86)98-47-27(3)96-59(46(87)50(47)101-57-43(84)40(81)37(78)26(2)95-57)102-51-38(79)32(75)20-92-60(51)104-62(89)68-14-12-63(4,5)16-29(68)28-10-11-35-64(6)17-31(74)54(65(7,22-71)52(64)30(73)18-67(35,9)66(28,8)13-15-68)103-58-44(85)41(82)49(34(19-70)97-58)100-61-53(88)69(90,23-72)24-93-61/h10,25-27,29-61,70-88,90H,11-24H2,1-9H3/t25-,26+,27-,29-,30?,31-,32-,33+,34+,35+,36-,37+,38-,39+,40-,41+,42+,43-,44+,45+,46+,47-,48-,49+,50-,51+,52+,53+,54-,55-,56-,57+,58-,59-,60-,61+,64?,65-,66?,67?,68-,69-/m0/s1 |
| InChIKey | UHZVMBJPPXNWAV-GOUBCDIXSA-N |
| Mol Weight | 1501.6 g/mol |
| Molecular Formula | C69H112O35 |
| Exact Mass | 1500.698415 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DSVfNXz6Ahl |
|---|---|
| Name | 3-O-[BETA-D-APIOFURANOSYL-(1->4)-BETA-D-GLUCOPYRANOSYL]-28-O-[ALPHA-L-RHAMNOPYRANOSYL-(1->3)-BETA-D-XYLOPYRANOSYL-(1->4)-[ALPHA-L-RHAMNOPYRANOSYL- |
| Compound Number | 11 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C69H112O35 |
| InChI | InChI=1S/C69H112O35/c1-25-36(77)39(80)42(83)56(94-25)99-48-33(76)21-91-55(45(48)86)98-47-27(3)96-59(46(87)50(47)101-57-43(84)40(81)37(78)26(2)95-57)102-51-38(79)32(75)20-92-60(51)104-62(89)68-14-12-63(4,5)16-29(68)28-10-11-35-64(6)17-31(74)54(65(7,22-71)52(64)30(73)18-67(35,9)66(28,8)13-15-68)103-58-44(85)41(82)49(34(19-70)97-58)100-61-53(88)69(90,23-72)24-93-61/h10,25-27,29-61,70-88,90H,11-24H2,1-9H3/t25-,26+,27-,29-,30?,31-,32-,33+,34+,35+,36-,37+,38-,39+,40-,41+,42+,43-,44+,45+,46+,47-,48-,49+,50-,51+,52+,53+,54-,55-,56-,57+,58-,59-,60-,61+,64?,65-,66?,67?,68-,69-/m0/s1 |
| InChIKey | UHZVMBJPPXNWAV-GOUBCDIXSA-N |
| Literature Reference Author | J.ESKANDER,C.LAVAUD,S.M.ABDEL-KHALIK,H.S.M.SOLIMAN,I.I.MAHMO UD,C.LONG |
| Literature Reference Citation | J.NAT.PROD.,68,832(2005) |
| Literature Reference DOI | 10.1021/np049582e |
| Molecular Weight | 1501.627 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ12045 |