(4S,4aR,5S,5aR,6S,12aS)-2-Acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11(4H,5H)-naphthacenedione

CAS Registry Number®

7647-65-6

CAS Name

(4S,4aR,5S,5aR,6S,12aS)-2-Acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11(4H,5H)-naphthacenedione

Molecular Formula

C23H25NO9

Molecular Mass

459.45

Cite this Page

(4S,4aR,5S,5aR,6S,12aS)-2-Acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11(4H,5H)-naphthacenedione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7647-65-6 (retrieved 2024-11-22) (CAS RN: 7647-65-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H25NO9/c1-8(25)11-18(28)16(24(3)4)15-19(29)14-13(21(31)23(15,33)20(11)30)17(27)12-9(22(14,2)32)6-5-7-10(12)26/h5-7,14-16,19,26,28-29,31-33H,1-4H3/t14-,15-,16+,19+,22-,23-/m1/s1

InChIKey

InChIKey=CXSLZLZWQICHIJ-JSILLTCQSA-N

SMILES

O[C@@]12[C@@]([C@@H](O)[C@]3(C(=C1O)C(=O)C=4C([C@@]3(C)O)=CC=CC4O)[H])([C@H](N(C)C)C(O)=C(C(C)=O)C2=O)[H]

Canonical SMILES

O=C1C=2C(O)=CC=CC2C(O)(C)C3C1=C(O)C4(O)C(=O)C(C(=O)C)=C(O)C(N(C)C)C4C3O

Other Names for this Substance

  • 1,11(4H,5H)-Naphthacenedione, 2-acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-, (4S,4aR,5S,5aR,6S,12aS)-
  • 1,11(4H,5H)-Naphthacenedione, 2-acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-
  • 1,11(4H,5H)-Naphthacenedione, 2-acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-, [4S-(4α,4aα,5α,5aα,6β,12aα)]-
  • (4S,4aR,5S,5aR,6S,12aS)-2-Acetyl-4-(dimethylamino)-4a,5a,6,12a-tetrahydro-3,5,6,10,12,12a-hexahydroxy-6-methyl-1,11(4H,5H)-naphthacenedione
  • 2-Acetyl-2-de(carbamoyloxy)tetracycline

View All

Deleted or Replaced CAS Registry Numbers

6986-98-7, 18752-00-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration