[(3R,4R,5R,8R,9R,10R,13S,14R,15S)-4-(3,3-dimethoxypropyl)-3-ethanoyl-4,9,10-trimethyl-15-propan-2-yl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ethanoate

Systemtic Name: [(3R,4R,5R,8R,9R,10R,13S,14R,15S)-4-(3,3-dimethoxypropyl)-3-ethanoyl-4,9,10-trimethyl-15-propan-2-yl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ethanoate Openeye Name: [(3R,4R,5R,8R,9R,10R,13S,14R,15S)-3-acetyl-4-(3,3-dimethoxypropyl)-15-isopropyl-4,9,10-trimethyl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl acetate CAS Name: acetic acid [(3R,4R,5R,8R,9R,10R,13S,14R,15S)-3-acetyl-4-(3,3-dimethoxypropyl)-4,9,10-trimethyl-15-propan-2-yl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ester IUPAC Name: [(3R,4R,5R,8R,9R,10R,13S,14R,15S)-3-acetyl-4-(3,3-dimethoxypropyl)-4,9,10-trimethyl-15-propan-2-yl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl acetate Traditional Name: acetic acid [(3R,4R,5R,8R,9R,10R,13S,14R,15S)-3-acetyl-4-(3,3-dimethoxypropyl)-15-isopropyl-4,9,10-trimethyl-2,3,5,6,7,8,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-13-yl]methyl ester Formula: C33H56O5 MolecularWeight: 532.79474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC2(C1C3CCC4C(C3(CC2)C)(CCC(C4(C)CCC(OC)OC)C(=O)C)C)COC(=O)C

Isomeric SMILES

CC(C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@H]4[C@]([C@@]3(CC2)C)(CC[C@H]([C@]4(C)CCC(OC)OC)C(=O)C)C)COC(=O)C

InChI

InChI=1S/C33H56O5/c1-21(2)24-12-17-33(20-38-23(4)35)19-18-31(6)26(29(24)33)10-11-27-30(5,15-14-28(36-8)37-9)25(22(3)34)13-16-32(27,31)7/h21,24-29H,10-20H2,1-9H3/t24-,25-,26+,27+,29+,30-,31+,32+,33+/m0/s1