(3α,9β,10α,16α,23E)-3,16,20,25-Tetrahydroxy-9-methyl-19-norlanosta-5,23-diene-2,11-dione

CAS Registry Number®

15371-77-4
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CAS Name

(3α,9β,10α,16α,23E)-3,16,20,25-Tetrahydroxy-9-methyl-19-norlanosta-5,23-diene-2,11-dione

Molecular Formula

C30H46O6

Molecular Mass

502.68

Cite this Page

(3α,9β,10α,16α,23E)-3,16,20,25-Tetrahydroxy-9-methyl-19-norlanosta-5,23-diene-2,11-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=15371-77-4 (retrieved 2024-09-19) (CAS RN: 15371-77-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H46O6/c1-25(2,35)12-9-13-29(7,36)23-20(32)15-27(5)21-11-10-17-18(14-19(31)24(34)26(17,3)4)30(21,8)22(33)16-28(23,27)6/h9-10,12,18,20-21,23-24,32,34-36H,11,13-16H2,1-8H3/b12-9+/t18-,20-,21+,23+,24-,27+,28-,29+,30+/m1/s1

InChIKey

InChIKey=LTAMPOZNZZLEID-XFFOSBMPSA-N

SMILES

C[C@]12[C@]3([C@](C)([C@]4(C(=CC3)C(C)(C)[C@H](O)C(=O)C4)[H])C(=O)C[C@]1(C)[C@@]([C@@](C/C=C/C(C)(C)O)(C)O)([C@H](O)C2)[H])[H]

Canonical SMILES

O=C1CC2C(=CCC3C2(C(=O)CC4(C)C(C(O)CC34C)C(O)(C)CC=CC(O)(C)C)C)C(C)(C)C1O

Other Names for this Substance

  • 19-Norlanosta-5,23-diene-2,11-dione, 3,16,20,25-tetrahydroxy-9-methyl-, (3α,9β,10α,16α,23E)-
  • 19-Nor-9β,10α-lanosta-5,23-diene-2,11-dione, 3β,16α,20,25-tetrahydroxy-9-methyl-
  • (3α,9β,10α,16α,23E)-3,16,20,25-Tetrahydroxy-9-methyl-19-norlanosta-5,23-diene-2,11-dione
  • Isocucurbitacin D, 22-deoxo-