Milbemycin D

CAS Registry Number®

77855-81-3
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CAS Name

Milbemycin D

Molecular Formula

C33H48O7

Molecular Mass

556.73

Cite this Page

Milbemycin D.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=77855-81-3 (retrieved 2024-04-27) (CAS RN: 77855-81-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C33H48O7/c1-19(2)29-22(5)12-13-32(40-29)17-26-16-25(39-32)11-10-21(4)14-20(3)8-7-9-24-18-37-30-28(34)23(6)15-27(31(35)38-26)33(24,30)36/h7-10,15,19-20,22,25-30,34,36H,11-14,16-18H2,1-6H3/b8-7-,21-10+,24-9-/t20-,22-,25+,26-,27-,28+,29+,30+,32+,33+/m0/s1

InChIKey

InChIKey=BWCRYQGQPDBOAU-VLEULYBXSA-N

SMILES

[C@@H](C)(C)[C@H]1O[C@@]2(C[C@@]3(C[C@](O2)(C/C=C(\C)/C[C@@H](C)/C=C\C=C\4/[C@@]5(O)[C@](C(=O)O3)(C=C(C)[C@@H](O)[C@]5(OC4)[H])[H])[H])[H])CC[C@@H]1C

Canonical SMILES

O=C1OC2CC(OC3(OC(C(C)C)C(C)CC3)C2)CC=C(C)CC(C=CC=C4COC5C(O)C(=CC1C45O)C)C

Other Names for this Substance

  • Milbemycin B, 5-O-demethyl-28-deoxy-6,28-epoxy-25-(1-methylethyl)-, (6R,25R)-
  • Spiro[11,15-methano-2H,13H,17H-furo[4,3,2-pq][2,6]benzodioxacyclooctadecin-13,2′-[2H]pyran], milbemycin B deriv.
  • (6R,25R)-5-O-Demethyl-28-deoxy-6,28-epoxy-25-(1-methylethyl)milbemycin B
  • Antibiotic B 41D
  • Milbemycin D

Deleted or Replaced CAS Registry Numbers

86090-81-5

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