2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-

CAS Registry Number®

197649-67-5

CAS Name

2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-

Molecular Formula

C21H28O6

Molecular Mass

376.44

Cite this Page

2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=197649-67-5 (retrieved 2025-03-12) (CAS RN: 197649-67-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H28O6/c1-9(2)10-13(22)11-12(15(24)14(10)23)21-8-6-7-20(3,4)18(21)17(16(11)26-5)27-19(21)25/h9,16-18,22-24H,6-8H2,1-5H3/t16-,17+,18-,21?/m0/s1

InChIKey

InChIKey=LBJNLIBZUVWVTE-YQMJFVBQSA-N

SMILES

O=C1C23[C@@]([C@](O1)([C@@H](OC)C=4C2=C(O)C(O)=C(C(C)C)C4O)[H])(C(C)(C)CCC3)[H]

Canonical SMILES

O=C1OC2C(OC)C3=C(O)C(=C(O)C(O)=C3C14CCCC(C)(C)C24)C(C)C

Other Names for this Substance

  • 2H-10,4a-(Epoxymethano)phenanthren-12-one, 1,3,4,9,10,10a-hexahydro-5,6,8-trihydroxy-9-methoxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9β,10α,10aβ)]-
  • 14-Hydroxy-7-O-methyl rosmanol

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