| Name |
Bianthrone 1a |
| Formula |
C50H54O8 |
| Mw |
782.3818687 |
| CAS RN |
849180-65-0 |
| C_ID |
C00029825
, 
|
| InChIKey |
UTUWDKGJRJNHEY-NFYQTQAWNA-N |
| InChICode |
InChI=1S/C50H54O8/c1-25(2)11-9-13-27(5)15-17-31-37(51)23-35-41(33-19-29(7)21-39(53)43(33)49(57)45(35)47(31)55)42-34-20-30(8)22-40(54)44(34)50(58)46-36(42)24-38(52)32(48(46)56)18-16-28(6)14-10-12-26(3)4/h11-12,15-16,19-24,41-42,51-56H,9-10,13-14,17-18H2,1-8H3/b27-15+,28-16+/t41-,42+ |
| SMILES |
CC(C)=CCC/C(C)=C/Cc1c(O)cc2c(c1O)C(=O)c1c(O)cc(C)cc1[C@H]2[C@H]1c2cc(C)cc(O)c2C(=O)c2c1cc(O)c(C/C=C(C)CCC=C(C)C)c2O |
| Start Substs in Alk. Biosynthesis (Prediction) |
|
| Organism |
| Kingdom |
Family |
Species |
Reference |
| Plantae | Hypericaceae | Psorospermum glaberrimum | Ref. |
|
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