| Name |
Acutanguloside C
(+)-Acutanguloside C |
| Formula |
C54H80O21 |
| Mw |
1064.51920962 |
| CAS RN |
849818-13-9 |
| C_ID |
C00042195
, 
|
| InChIKey |
BVLILAASBFCECD-QOHWYYFONA-N |
| InChICode |
InChI=1S/C54H80O21/c1-49(2)19-26-25-13-14-30-51(5)17-16-32(50(3,4)29(51)15-18-52(30,6)53(25,7)20-31(58)54(26,23-56)42(65)43(49)75-45(68)24-11-9-8-10-12-24)71-48-41(74-47-37(63)35(61)34(60)28(21-55)70-47)39(38(64)40(73-48)44(66)67)72-46-36(62)33(59)27(57)22-69-46/h8-13,26-43,46-48,55-65H,14-23H2,1-7H3,(H,66,67)/t26-,27+,28+,29-,30+,31+,32-,33-,34-,35-,36+,37+,38-,39-,40-,41+,42-,43-,46-,47-,48+,51-,52+,53+,54-/m0/s1 |
| SMILES |
C1[C@]2([C@H](C([C@H](C1)O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O[C@@H]1OC[C@H]([C@@H]([C@H]1O)O)O)O)C(=O)O)(C)C)CC[C@@]1([C@@H]2CC=C2[C@]1(C[C@H]([C@@]1([C@H]2CC([C@H]([C@@H]1O)OC(=O)c1ccccc1)(C)C)CO)O)C)C)C |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Lecythidaceae | Barringtonia acutangula  | Ref. |
|
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