(2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-[(2S,4R,5S,6R)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxyethyl]-17-oxidanyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-oxane-3,5-diol

Systemtic Name: (2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-[(2S,4R,5S,6R)-6-methyl-4,5-bis(oxidanyl)oxan-2-yl]oxyethyl]-17-oxidanyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-oxane-3,5-diol Openeye Name: (2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-tetrahydropyran-3,5-diol CAS Name: (2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-[[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyl-2-oxanyl]oxy]ethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxane-3,5-diol IUPAC Name: (2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyloxane-3,5-diol Traditional Name: (2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9S,10S,13S,14S,17R)-17-[(1S)-1-[(2S,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxyethyl]-17-hydroxy-10,13-dimethyl-1,2,3,4,5,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-yl]oxy]-4-methoxy-6-methyl-tetrahydropyran-3,5-diol Formula: C34H56O10 MolecularWeight: 624.80244

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC(C)C2(CCC3C2(CCC4C3C=CC5C4(CCC(C5)OC6C(C(C(C(O6)C)O)OC)O)C)C)O)O)O

Isomeric SMILES

C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O[C@@H](C)[C@]2(CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3C=C[C@@H]5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@H]([C@H](O6)C)O)OC)O)C)C)O)O)O

InChI

InChI=1S/C34H56O10/c1-17-27(36)25(35)16-26(41-17)43-19(3)34(39)14-11-24-22-8-7-20-15-21(9-12-32(20,4)23(22)10-13-33(24,34)5)44-31-29(38)30(40-6)28(37)18(2)42-31/h7-8,17-31,35-39H,9-16H2,1-6H3/t17-,18-,19+,20+,21+,22-,23+,24+,25-,26+,27-,28+,29-,30+,31+,32+,33+,34+/m1/s1