Catalog Number
ACM51804683
Product Name
Oxoepistephamiersine
Category
Heterocyclic Organic Compound
Synonyms
3,4,7,8-Tetramethoxy-12-methyl-7,8,9,10-tetrahydro-8a,4b-(epiminoethano)-8,10-epoxyphenanthrene-6,13(5H)-dione
Molecular Formula
C21H25NO7
InChI
InChI=1S/C21H25NO7/c1-22-15(24)10-19-8-12(23)18(27-4)21(28-5)20(19,22)9-14(29-21)11-6-7-13(25-2)17(26-3)16(11)19/h6-7,14,18H,8-10H2,1-5H3/t14-,18+,19,20+,21/m1/s1
InChI Key
UMLCCHVXIGOAFZ-BXPSQMFMSA-N
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
3
Hydrogen Bond Acceptor Count
7
Hydrogen Bond Donor Count
0
Isomeric SMILES
CN1C(=O)CC23[C@]14C[C@H](C5=C2C(=C(C=C5)OC)OC)OC4([C@H](C(=O)C3)OC)OC
Monoisotopic Mass
403.16310214
Physical Description
Powder
Topological Polar Surface Area
83.5 Ų