PDNHV

Product Specifications

CAS Number

251362-87-5

Hazard Statement

No Data Available

Smiles

CCCCCCCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@@H](C=C(COC(=O)Cc3ccc(O)c(OC)c3)C[C@@]4(O)[C@H]2C=C(C)C4=O)[C@@H]5C(C)(C)[C@]15OC(=O)CCCCCCCC

Molecular Formula

C47 H68 O11

Molecular Weight

809.036

InChI

InChI=1S/C47H68O11/c1-8-10-12-14-16-18-20-38(49)57-43-31(4)46(54)34(41-44(5,6)47(41,43)58-39(50)21-19-17-15-13-11-9-2)25-33(28-45(53)37(46)24-30(3)42(45)52)29-56-40(51)27-32-22-23-35(48)36(26-32)55-7/h22-26,31,34,37,41,43,48,53-54H,8-21,27-29H2,1-7H3/t31-,34+,37-,41-,43-,45-,46-,47-/m1/s1

Additionnal Information

IUPAC name: [(1S,2S,6R,10S,11R,13S,14R,15R)-1,6-dihydroxy-8-[[2-(4-hydroxy-3-methoxyphenyl)acetyl]oxymethyl]-4,12,12,15-tetramethyl-13-nonanoyloxy-5-oxo-14-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] nonanoate