| Name |
Ilwensisaponin D |
| Formula |
C54H90O22 |
| Mw |
1090.59237456 |
| CAS RN |
149930-25-6 |
| C_ID |
C00063913
|
| InChIKey |
SFZQHRCCWJKHIW-UHFFFAOYSA-N |
| InChICode |
InChI=1S/C54H90O22/c1-23-32(60)35(63)38(66)45(69-23)74-41-29(20-56)72-47(40(68)37(41)65)75-42-33(61)24(2)70-48(43(42)76-46-39(67)36(64)34(62)28(19-55)71-46)73-31-10-11-50(5)30(51(31,6)21-57)9-12-53(8)44(50)27(59)17-25-26-18-49(3,4)13-15-54(26,22-58)16-14-52(25,53)7/h17,23-24,26-48,55-68H,9-16,18-22H2,1-8H3 |
| SMILES |
CC1OC(OC2C(CO)OC(OC3C(O)C(C)OC(OC4CCC5(C)C(CCC6(C)C5C(O)C=C5C7CC(C)(C)CCC7(CO)CCC56C)C4(C)CO)C3OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Scrophulariaceae | Scrophularia ilwensis | Ref. |
|
|
zoom in
| Organism | Scrophularia ilwensis |
|---|
| Reference | Singh, B and Sharma, R. V., Secondary Metabolites of Medicinal Plants, Vol. 3, (2020), Wiley-VCH Verlag GmbH and Co. KGaA. |
|---|
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