![3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-OLEAN-12-ENE-28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALP](/api/spectrum/9ohob7wLwFs/structure.png?h=300&w=458 "3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-OLEAN-12-ENE-28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALP")
| SpectraBase Compound ID | J3FtkO8nfO4 |
|---|---|
| InChI | InChI=1S/C71H116O35/c1-26-38(76)55(103-59-48(86)44(82)41(79)31(21-72)97-59)52(90)62(95-26)102-54-33(23-74)99-58(51(89)47(54)85)94-25-34-43(81)46(84)50(88)61(100-34)106-65(92)71-18-16-66(3,4)20-29(71)28-10-11-36-68(7)14-13-37(67(5,6)35(68)12-15-70(36,9)69(28,8)17-19-71)101-64-57(40(78)30(75)24-93-64)105-63-53(91)56(39(77)27(2)96-63)104-60-49(87)45(83)42(80)32(22-73)98-60/h10,26-27,29-64,72-91H,11-25H2,1-9H3/t26-,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+,62+,63-,64-,68+,69-,70-,71+/m1/s1 |
| InChIKey | MKFYQKMLMKAHSO-RAKIYJRMSA-N |
| Mol Weight | 1529.7 g/mol |
| Molecular Formula | C71H116O35 |
| Exact Mass | 1528.729715 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9ohob7wLwFs |
|---|---|
| Name | 3-BETA-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-ALPHA-L-ARABINOPYRANOSYL]-OLEAN-12-ENE-28-O-[BETA-D-GLUCOPYRANOSYL-(1->3)-ALP |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C71H116O35 |
| InChI | InChI=1S/C71H116O35/c1-26-38(76)55(103-59-48(86)44(82)41(79)31(21-72)97-59)52(90)62(95-26)102-54-33(23-74)99-58(51(89)47(54)85)94-25-34-43(81)46(84)50(88)61(100-34)106-65(92)71-18-16-66(3,4)20-29(71)28-10-11-36-68(7)14-13-37(67(5,6)35(68)12-15-70(36,9)69(28,8)17-19-71)101-64-57(40(78)30(75)24-93-64)105-63-53(91)56(39(77)27(2)96-63)104-60-49(87)45(83)42(80)32(22-73)98-60/h10,26-27,29-64,72-91H,11-25H2,1-9H3/t26-,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+,62+,63-,64-,68+,69-,70-,71+/m1/s1 |
| InChIKey | MKFYQKMLMKAHSO-RAKIYJRMSA-N |
| Literature Reference Author | N.DETOMMASI,G.AUTORE,A.BELLINO,A.PINTO,C.PIZZA,R.SORRENTINO, P.VENTURELLA |
| Literature Reference Citation | J.NAT.PROD.,63,308(2000) |
| Literature Reference DOI | 10.1021/np990231n |
| Molecular Weight | 1529.681 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU4094 |