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Substance Name: Lanosta-7,9(11)-dien-21-oic acid, 3-hydroxy-24-methylene-, (3beta)-, mixt. with (3beta)-3-hydroxy-24-methylenelanost-8-en-21-oic acid and 24-methylene-3-oxolanosta-7,9(11)-dien-21-oic acid
RN: 8067-18-3
InChIKey: WLOSEVGAHMZXGF-RRTZJPIVSA-N

Molecular Formula

  • C31-H50-O3.C31-H48-O3.C31-H46-O3

Molecular Weight

  • 1406.1516
 
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Names and Synonyms

  • Lanosta-7,9(11)-dien-21-oic acid, 3-hydroxy-24-methylene-, (3beta)-, mixt. with (3beta)-3-hydroxy-24-methylenelanost-8-en-21-oic acid and 24-methylene-3-oxolanosta-7,9(11)-dien-21-oic acid

Registry Numbers

CAS Registry Number

  • 8067-18-3

System Generated Number

  • 0008067183

Molecular Formulas

Molecular Formula

  • C31-H50-O3.C31-H48-O3.C31-H46-O3

Molecular Formula Fragments

  • C31-H46-O3
  • C31-H48-O3
  • C31-H50-O3
  • COMPONENT

Structure Descriptors

InChI

1S/C31H50O3.C31H48O3.C31H46O3/c3*1-19(2)20(3)9-10-21(27(33)34)22-13-17-31(8)24-11-12-25-28(4,5)26(32)15-16-29(25,6)23(24)14-18-30(22,31)7/h19,21-22,25-26,32H,3,9-18H2,1-2,4-8H3,(H,33,34);11,14,19,21-22,25-26,32H,3,9-10,12-13,15-18H2,1-2,4-8H3,(H,33,34);11,14,19,21-22,25H,3,9-10,12-13,15-18H2,1-2,4-8H3,(H,33,34)/t2*21-,22-,25?,26+,29-,30-,31+;21-,22-,25?,29-,30-,31+/m111/s1

InChIKey

WLOSEVGAHMZXGF-RRTZJPIVSA-N

Smiles

CC(C)C(=C)CC[C@H]([C@H]1CC[C@@]2([C@@]1(CCC3=C2CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)C(=O)O.CC(C)C(=C)CC[C@H]([C@H]1CC[C@@]2([C@@]1(CC=C3C2=CCC4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C)C(=O)O.CC(C)C(=C)CC[C@H]([C@H]1CC[C@@]2([C@@]1(CC=C3C2=CCC4[C@@]3(CCC(=O)C4(C)C)C)C)C)C(=O)O