11,16-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[3,4-c]pyridine-7,19-dione, 13,14,21,22-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-5,6,9,10,12,13,14,15,16,17-decahydro-10,23-dihydroxy-5,6,10,16-tetramethyl-, (5S,6S,9S,10S,11S,12S,13S,14R,15R,16R,21R,22R,23R)-
CAS Registry Number®
CAS Name
11,16-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[3,4-c]pyridine-7,19-dione, 13,14,21,22-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-5,6,9,10,12,13,14,15,16,17-decahydro-10,23-dihydroxy-5,6,10,16-tetramethyl-, (5S,6S,9S,10S,11S,12S,13S,14R,15R,16R,21R,22R,23R)-Molecular Formula
C36H45NO17Molecular Mass
763.74Cite this Page
11,16-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[3,4-c]pyridine-7,19-dione, 13,14,21,22-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-5,6,9,10,12,13,14,15,16,17-decahydro-10,23-dihydroxy-5,6,10,16-tetramethyl-, (5S,6S,9S,10S,11S,12S,13S,14R,15R,16R,21R,22R,23R)-. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=262599-02-0 (retrieved ) (CAS RN: 262599-02-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C36H45NO17/c1-15-16(2)31(44)53-28-25(43)29(51-20(6)41)35(14-47-17(3)38)30(52-21(7)42)26(49-18(4)39)24-27(50-19(5)40)36(35,34(28,9)46)54-33(24,8)13-48-32(45)23-12-37-11-10-22(15)23/h10-12,15-16,24-30,43,46H,13-14H2,1-9H3/t15-,16-,24+,25-,26+,27+,28-,29-,30+,33-,34-,35-,36-/m0/s1
InChIKey
InChIKey=NZJBHDRNBSDTHF-XWOHFTJRSA-N
SMILES
C(OC(C)=O)[C@]12[C@@]34[C@H](OC(C)=O)[C@]([C@@](C)(O3)COC(=O)C=5C([C@@H](C)[C@H](C)C(=O)O[C@]([C@]4(C)O)([C@H](O)[C@@H]1OC(C)=O)[H])=CC=NC5)([C@@H](OC(C)=O)[C@H]2OC(C)=O)[H]
Canonical SMILES
O=C1OCC2(OC34C(OC(=O)C)C2C(OC(=O)C)C(OC(=O)C)C4(COC(=O)C)C(OC(=O)C)C(O)C(OC(=O)C(C)C(C=5C=CN=CC15)C)C3(O)C)C
Other Names for this Substance
- 11,16-Epoxy-9,12-ethano-11,15-methano-11H-[1,8]dioxacycloheptadecino[3,4-c]pyridine-7,19-dione, 13,14,21,22-tetrakis(acetyloxy)-12-[(acetyloxy)methyl]-5,6,9,10,12,13,14,15,16,17-decahydro-10,23-dihydroxy-5,6,10,16-tetramethyl-, (5S,6S,9S,10S,11S,12S,13S,14R,15R,16R,21R,22R,23R)-
- Wilfordinine A