(3R,7S,8R,10S,14R)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-4,4,8,10,14-pentamethyl-7-oxidanyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one

Systemtic Name: (3R,7S,8R,10S,14R)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]oxy-4,5-bis(oxidanyl)oxan-2-yl]oxy-4,4,8,10,14-pentamethyl-7-oxidanyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one Openeye Name: (3R,7S,8R,10S,14R)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-7-hydroxy-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one CAS Name: (3R,7S,8R,10S,14R)-3-[[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-oxanyl]oxy]-2-oxanyl]oxy]-7-hydroxy-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one IUPAC Name: (3R,7S,8R,10S,14R)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-7-hydroxy-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one Traditional Name: (3R,7S,8R,10S,14R)-3-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-methylol-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-tetrahydropyran-2-yl]oxy-7-hydroxy-4,4,8,10,14-pentamethyl-1,3,5,6,7,9,11,12,13,15-decahydrocyclopenta[a]phenanthren-2-one Formula: C34H54O13 MolecularWeight: 670.78476

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC(C3(C(C2(CC(=O)C1OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)C)CCC6C3(CC=C6)C)C)O)C

Isomeric SMILES

C[C@@]12CC=CC1CCC3[C@]2([C@H](CC4[C@@]3(CC(=O)[C@@H](C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)C)O)C

InChI

InChI=1S/C34H54O13/c1-31(2)20-11-21(38)34(5)19(9-8-15-7-6-10-33(15,34)4)32(20,3)12-16(37)28(31)47-30-27(25(42)23(40)18(14-36)45-30)46-29-26(43)24(41)22(39)17(13-35)44-29/h6-7,15,17-30,35-36,38-43H,8-14H2,1-5H3/t15?,17-,18-,19?,20?,21+,22-,23-,24+,25+,26-,27-,28+,29+,30+,32-,33-,34+/m1/s1