Rosmaricine

CAS Registry Number®

3650-11-1
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CAS Name

Rosmaricine

Molecular Formula

C20H27NO4

Molecular Mass

345.43

Cite this Page

Rosmaricine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3650-11-1 (retrieved 2024-09-19) (CAS RN: 3650-11-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H27NO4/c1-9(2)10-8-11-12(15(23)14(10)22)20-7-5-6-19(3,4)17(20)16(13(11)21)25-18(20)24/h8-9,13,16-17,22-23H,5-7,21H2,1-4H3/t13-,16-,17+,20?/m1/s1

InChIKey

InChIKey=NFXKGLBUURRKEA-LBDFLTNNSA-N

SMILES

O=C1[C@]23C=4C([C@@H](N)[C@]([C@]2(C(C)(C)CCC3)[H])(O1)[H])=CC(C(C)C)=C(O)C4O

Canonical SMILES

O=C1OC2C(N)C3=CC(=C(O)C(O)=C3C14CCCC(C)(C)C24)C(C)C

Other Names for this Substance

  • 2H-10,4a-(Epoxymethano)phenanthren-12-one, 9-amino-1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, (4aR,9R,10S,10aS)-
  • Podocarpa-8,11,13-trien-17-oic acid, 7β-amino-6β,11,12-trihydroxy-13-isopropyl-, 17,6-lactone
  • 2H-10,4a-(Epoxymethano)phenanthren-12-one, 9-amino-1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-, [4aR-(4aα,9α,10α,10aβ)]-
  • (4aR,9R,10S,10aS)-9-Amino-1,3,4,9,10,10a-hexahydro-5,6-dihydroxy-1,1-dimethyl-7-(1-methylethyl)-2H-10,4a-(epoxymethano)phenanthren-12-one
  • Rosmaricine

Deleted or Replaced CAS Registry Numbers

802588-06-3