Name |
Marsdenoside A (+)-Marsdenoside A |
Formula |
C45H70O14 |
Mw |
834.47655695 |
CAS RN |
858360-56-2 |
C_ID |
C00035678
,
|
InChIKey |
RZEWOQQBEXNIGQ-RBIZQYLNNA-N |
InChICode |
InChI=1S/C45H70O14/c1-12-22(3)39(49)56-36-37-42(8)17-15-28(55-31-21-30(51-10)34(26(7)53-31)57-41-33(48)35(52-11)32(47)25(6)54-41)20-27(42)14-18-44(37)45(59-44)19-16-29(24(5)46)43(45,9)38(36)58-40(50)23(4)13-2/h13,22,25-38,41,47-48H,12,14-21H2,1-11H3/b23-13+/t22-,25-,26-,27+,28+,29+,30-,31+,32-,33-,34-,35-,36+,37-,38-,41+,42+,43+,44+,45-/m1/s1 |
SMILES |
C1[C@@H](C[C@H]2[C@](C1)([C@@H]1[C@@]3(CC2)[C@@]2([C@]([C@@H]([C@H]1OC(=O)[C@@H](CC)C)OC(=O)/C(=C/C)/C)([C@@H](CC2)C(=O)C)C)O3)C)O[C@@H]1O[C@@H]([C@H]([C@@H](C1)OC)O[C@H]1[C@@H]([C@@H]([C@@H]([C@H](O1)C)O)OC)O)C |
Start Substs in Alk. Biosynthesis (Prediction) |
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Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Apocynaceae | Marsdenia tenacissima | Ref. |
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zoom in
Organism | Marsdenia tenacissima | Reference | Deng,Phytochem.,66,(2005),1040 |
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