CCRIS 3069

Also Known As: 2-(3-((9a-(Acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa(3,4)benz(1,2-e)azulen-9-yl)oxy)-3-oxopropyl)-2-dodecyl-4,4-dimethyl-3-oxazolidinyloxy|[2-(3-{[9a-(Acetyloxy)-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-1H-cyclopropa[3,4]benzo[1,2-e]azulen-9-yl]oxy}-3-oxopropyl)-2-(dodecan-2-yl)-4,4-dimethyl-1,3-oxazolidin-3-yl]oxidanyl|2-[3-[[9A-(ACETYLOXY)-1A,1B,4,4A,5,7A,7B,8,9,9A-DECAHYDRO-4A,7B-DIHYDROXY-3-(HYDROXYMETHYL)-1,1,6,8- TETRAMETHYL-5-OXO-1H-CYCLOPROPA[3,4]BENZ[1,2-E]AZULEN-|2-[3-[[9a-(Acetyloxy)-1a,1b,4,4a,5,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-5-oxo-1H-cyclopropa[3,4]benz[1,2-e]azulen-9-yl]oxy]-3-oxopropyl]-2-dodecyl-4,4-dimethyl-3-oxazolidinyloxy

Molecular Formula	C42H66NO10
Molecular Weight	744.4687 g/mol
LogP	6.4
Topological Polar Surface Area	144.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	10
Rotatable Bonds	18
Exact Mass	744.4687
Monoisotopic Mass	744.4687
Heavy Atoms	53
Complexity	1470.0

Chemical Identifiers

CAS Number	92590-45-9
SMILES	CCCCCCCCCCC(C)C1(N(C(CO1)(C)C)[O])CCC(=O)OC2C(C3(C(C=C(CC4(C3C=C(C4=O)C)O)CO)C5C2(C5(C)C)OC(=O)C)O)C
InChIKey	PCRAPGRGPUQMQX-UHFFFAOYSA-N