[2-[[3-ethenyl-3,4a,7,7,10a-pentamethyl-6,10,10b-tris(oxidanyl)-1-oxidanylidene-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl]oxy]-2-oxidanylidene-ethyl] 2-[bis(prop-2-enyl)amino]ethanoate hydrochloride

Systemtic Name: [2-[[3-ethenyl-3,4a,7,7,10a-pentamethyl-6,10,10b-tris(oxidanyl)-1-oxidanylidene-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl]oxy]-2-oxidanylidene-ethyl] 2-[bis(prop-2-enyl)amino]ethanoate hydrochloride Openeye Name: [2-[(6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-3-vinyl-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl)oxy]-2-oxo-ethyl] 2-(diallylamino)acetate hydrochloride CAS Name: 2-[bis(prop-2-enyl)amino]acetic acid [2-[(3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f][1]benzopyran-5-yl)oxy]-2-oxoethyl] ester hydrochloride IUPAC Name: [2-[(3-ethenyl-6,10,10b-trihydroxy-3,4a,7,7,10a-pentamethyl-1-oxo-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl)oxy]-2-oxoethyl] 2-[bis(prop-2-enyl)amino]acetate hydrochloride Traditional Name: 2-(diallylamino)acetic acid [2-[(6,10,10b-trihydroxy-1-keto-3,4a,7,7,10a-pentamethyl-3-vinyl-5,6,6a,8,9,10-hexahydro-2H-benzo[f]chromen-5-yl)oxy]-2-keto-ethyl] ester hydrochloride Formula: C30H46ClNO9 MolecularWeight: 600.14054

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2(C1C(C(C3(C2(C(=O)CC(O3)(C)C=C)O)C)OC(=O)COC(=O)CN(CC=C)CC=C)O)C)O)C.Cl

Isomeric SMILES

CC1(CCC(C2(C1C(C(C3(C2(C(=O)CC(O3)(C)C=C)O)C)OC(=O)COC(=O)CN(CC=C)CC=C)O)C)O)C.Cl

InChI

InChI=1S/C30H45NO9.ClH/c1-9-14-31(15-10-2)17-21(34)38-18-22(35)39-25-23(36)24-26(4,5)13-12-19(32)28(24,7)30(37)20(33)16-27(6,11-3)40-29(25,30)8;/h9-11,19,23-25,32,36-37H,1-3,12-18H2,4-8H3;1H