12-Deoxyerythronolide A

CAS Registry Number®

3225-82-9
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CAS Name

12-Deoxyerythronolide A

Molecular Formula

C21H38O7

Molecular Mass

402.52

Cite this Page

12-Deoxyerythronolide A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3225-82-9 (retrieved 2024-05-06) (CAS RN: 3225-82-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H38O7/c1-8-15-11(3)17(23)12(4)16(22)10(2)9-21(7,27)19(25)13(5)18(24)14(6)20(26)28-15/h10-15,17-19,23-25,27H,8-9H2,1-7H3/t10-,11+,12+,13+,14-,15-,17+,18+,19-,21-/m1/s1

InChIKey

InChIKey=ZFBRGCCVTUPRFQ-HWRKYNCUSA-N

SMILES

C(C)[C@@H]1[C@H](C)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@](C)(O)[C@H](O)[C@@H](C)[C@H](O)[C@@H](C)C(=O)O1

Canonical SMILES

O=C1OC(CC)C(C)C(O)C(C(=O)C(C)CC(O)(C)C(O)C(C)C(O)C1C)C

Other Names for this Substance

  • Erythronolide A, 12-deoxy-
  • Oxacyclotetradecane-2,10-dione, 14-ethyl-4,6,7,12-tetrahydroxy-3,5,7,9,11,13-hexamethyl-, (3R,4S,5S,6R,7R,9R,11R,12S,13R,14R)-
  • Oxacyclotetradecane, erythronolide A deriv.
  • 12-Deoxyerythronolide A
  • Erythronolide B

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Deleted or Replaced CAS Registry Numbers

19270-26-9, 24784-66-5

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