[(1r,3As,5r,8ar,9r,9ar)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl]acetate

Catalog Number

ACM10092043

Product Name

[(1r,3As,5r,8ar,9r,9ar)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl]acetate

Structure

CAS

10092-04-3

Category

Heterocyclic Organic Compound

Synonyms

Isotenulin, AIDS014780, AIDS-014780, CID73482, NSC85247, NSC 85247, 10092-04-3, Ambros-2-en-12-oic acid, 6beta,8alpha-dihydroxy-4-oxo-, 12,8-lactone, acetate, (11R)- (8CI), Azuleno(6,5-b)furan-2,5-dione, 4-(acetyloxy)-3,3a,4,4a,7a,8,9,9a-octahydro-3,4a,8-trimethyl-, (3R-(3alpha,3aalpha,4beta,4abeta,7aalpha,8alpha,9abeta))- (9CI), Ibogamine-18-carboxylic acid, 12-methoxy-13-[(3.alpha.)-17-methoxy-17-oxovobasan-3-yl]-, methyl ester

IUPAC Name

[(1R,3aS,5R,8aR,9R,9aR)-1,5,8a-trimethyl-2,8-dioxo-3a,4,5,5a,9,9a-hexahydro-1H-azuleno[6,5-b]furan-9-yl] acetate

Molecular Weight

306.354 g/mol

Molecular Formula

C₁₇H₂₂O₅

Canonical SMILES

CC1CC2C(C(C(=O)O2)C)C(C3(C1C=CC3=O)C)OC(=O)C

InChI Key

NEIIKBWBBCJSQU-DGIONXRUSA-N

Boiling Point

455.8ºC at 760mmHg

Flash Point

201.6ºC

Density

1.21g/cm³

Exact Mass

306.14700

H-Bond Acceptor

5

H-Bond Donor

0

MSDS

COA

Spec Sheet