(2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloranyl-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol

Systemtic Name: (2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloranyl-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol Openeye Name: (2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloro-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol CAS Name: (2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloro-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol IUPAC Name: (2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloro-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol Traditional Name: (2R,4aS,4bS,6aS,7S,8R,10aS,10bR,12aR)-7-chloro-4a,6a,8-trimethyl-1,2,3,4,4b,5,6,7,8,9,10,10a,10b,11,12,12a-hexadecahydrochrysen-2-ol Formula: C21H35ClO MolecularWeight: 338.955

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C3CCC4CC(CCC4(C3CCC2(C1Cl)C)C)O

Isomeric SMILES

C[C@@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](CC[C@@]4([C@H]3CC[C@@]2([C@H]1Cl)C)C)O

InChI

InChI=1S/C21H35ClO/c1-13-4-7-17-16-6-5-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,3)19(13)22/h13-19,23H,4-12H2,1-3H3/t13-,14-,15-,16+,17+,18+,19+,20+,21+/m1/s1