(2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R,5S)-6-methyl-5-oxidanyl-heptan-2-yl]-3-oxidanyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyl-oxane-3,4,5-triol

Systemtic Name: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-10,13-dimethyl-17-[(2R,5S)-6-methyl-5-oxidanyl-heptan-2-yl]-3-oxidanyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyl-oxane-3,4,5-triol Openeye Name: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-3-hydroxy-17-[(1R,4S)-4-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyl-tetrahydropyran-3,4,5-triol CAS Name: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-3-hydroxy-17-[(2R,5S)-5-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyloxane-3,4,5-triol IUPAC Name: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-3-hydroxy-17-[(2R,5S)-5-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyloxane-3,4,5-triol Traditional Name: (2R,3R,4S,5S,6R)-2-[[(3S,5S,6S,8S,10S,13R,14S,17R)-3-hydroxy-17-[(1R,4S)-4-hydroxy-1,5-dimethyl-hexyl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-methyl-tetrahydropyran-3,4,5-triol Formula: C33H56O7 MolecularWeight: 564.79354

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(C(O1)OC2CC3C4CCC(C4(CC=C3C5(C2CC(CC5)O)C)C)C(C)CCC(C(C)C)O)O)O)O

Isomeric SMILES

C[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]3[C@@H]4CC[C@@H]([C@]4(CC=C3[C@@]5([C@@H]2C[C@H](CC5)O)C)C)[C@H](C)CC[C@@H](C(C)C)O)O)O)O

InChI

InChI=1S/C33H56O7/c1-17(2)26(35)10-7-18(3)22-8-9-23-21-16-27(40-31-30(38)29(37)28(36)19(4)39-31)25-15-20(34)11-13-33(25,6)24(21)12-14-32(22,23)5/h12,17-23,25-31,34-38H,7-11,13-16H2,1-6H3/t18-,19-,20+,21+,22-,23+,25-,26+,27+,28-,29+,30-,31+,32-,33-/m1/s1