![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/4l0ihJPYwgt/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 | AWVzlbUVJL8 |
|---|---|
| InChI | InChI=1S/C69H112O36/c1-24-36(78)39(81)42(84)56(95-24)100-48-32(76)20-92-55(45(48)87)99-47-26(3)97-59(46(88)50(47)102-57-43(85)40(82)37(79)25(2)96-57)103-51-38(80)31(75)19-93-60(51)105-62(90)69-13-12-63(4,5)14-28(69)27-10-11-34-64(6)15-30(74)54(65(7,21-71)52(64)29(73)16-67(34,9)66(27,8)17-35(69)77)104-58-44(86)41(83)49(33(18-70)98-58)101-61-53(89)68(91,22-72)23-94-61/h10,24-26,28-61,70-89,91H,11-23H2,1-9H3/t24-,25+,26-,28-,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 | XVTLJSYUBWHGNZ-MYLGHLAYSA-N |
| Mol Weight | 1517.6 g/mol |
| Molecular Formula | C69H112O36 |
| Exact Mass | 1516.69333 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4l0ihJPYwgt |
|---|---|
| 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 | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C69H112O36 |
| InChI | InChI=1S/C69H112O36/c1-24-36(78)39(81)42(84)56(95-24)100-48-32(76)20-92-55(45(48)87)99-47-26(3)97-59(46(88)50(47)102-57-43(85)40(82)37(79)25(2)96-57)103-51-38(80)31(75)19-93-60(51)105-62(90)69-13-12-63(4,5)14-28(69)27-10-11-34-64(6)15-30(74)54(65(7,21-71)52(64)29(73)16-67(34,9)66(27,8)17-35(69)77)104-58-44(86)41(83)49(33(18-70)98-58)101-61-53(89)68(91,22-72)23-94-61/h10,24-26,28-61,70-89,91H,11-23H2,1-9H3/t24-,25+,26-,28-,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 | XVTLJSYUBWHGNZ-MYLGHLAYSA-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 | 1517.627 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMZ12044 |