Cucurbitacin J

CAS Registry Number®

622784-89-8
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CAS Name

Cucurbitacin J

Molecular Formula

C30H44O8

Molecular Mass

532.67

Cite this Page

Cucurbitacin J.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5979-41-9 (retrieved 2024-09-19) (CAS RN: 622784-89-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    145-184 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C30H44O8/c1-25(2)15-9-10-19-27(5)13-18(32)23(30(8,38)21(34)12-20(33)26(3,4)37)28(27,6)14-22(35)29(19,7)16(15)11-17(31)24(25)36/h9,11,16,18-20,23,31-33,37-38H,10,12-14H2,1-8H3/t16-,18-,19+,20-,23+,27+,28-,29+,30+/m1/s1

InChIKey

InChIKey=FBGLZDYMEULGSX-CQPOVTOMSA-N

SMILES

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

Canonical SMILES

O=C1C(O)=CC2C(=CCC3C2(C(=O)CC4(C)C(C(O)CC34C)C(O)(C(=O)CC(O)C(O)(C)C)C)C)C1(C)C

Other Names for this Substance

  • 19-Norlanosta-1,5-diene-3,11,22-trione, 2,16,20,24,25-pentahydroxy-9-methyl-, (9β,10α,16α,24R)-
  • (9β,10α,16α,24R)-2,16,20,24,25-Pentahydroxy-9-methyl-19-norlanosta-1,5-diene-3,11,22-trione
  • 24-epi-Cucurbitacin K
  • Cucurbitacin J
  • NSC 112165

View All

Deleted or Replaced CAS Registry Numbers

1363-69-5, 5979-41-9