Hemslecin A

CAS Registry Number®

58546-34-2
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CAS Name

Hemslecin A

Molecular Formula

C32H50O8

Molecular Mass

562.73

Cite this Page

Hemslecin A.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58546-34-2 (retrieved 2024-08-22) (CAS RN: 58546-34-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C32H50O8/c1-17(33)40-27(2,3)13-12-23(36)32(9,39)25-21(35)15-29(6)22-11-10-18-19(14-20(34)26(38)28(18,4)5)31(22,8)24(37)16-30(25,29)7/h10,19-22,25-26,34-35,38-39H,11-16H2,1-9H3/t19-,20+,21-,22+,25+,26-,29+,30-,31+,32+/m1/s1

InChIKey

InChIKey=LKYNAQSYQLFTCM-GYXNDICUSA-N

SMILES

C[C@]12[C@@](C)([C@@]([C@@](C(CCC(OC(C)=O)(C)C)=O)(C)O)([C@H](O)C1)[H])CC(=O)[C@]3(C)[C@]2(CC=C4[C@]3(C[C@H](O)[C@@H](O)C4(C)C)[H])[H]

Canonical SMILES

O=C(OC(C)(C)CCC(=O)C(O)(C)C1C(O)CC2(C)C3CC=C4C(CC(O)C(O)C4(C)C)C3(C(=O)CC12C)C)C

Other Names for this Substance

  • 19-Norlanost-5-ene-11,22-dione, 25-(acetyloxy)-2,3,16,20-tetrahydroxy-9-methyl-, (2β,3α,9β,10α,16α)-
  • (2β,3α,9β,10α,16α)-25-(Acetyloxy)-2,3,16,20-tetrahydroxy-9-methyl-19-norlanost-5-ene-11,22-dione
  • Cucurbitacin IIa
  • Dihydrocucurbitacin F 25-O-acetate
  • 25-Acetoxy-23,24-dihydrocucurbitacin F

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Deleted or Replaced CAS Registry Numbers

96158-05-3, 129357-90-0