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Substance Name: Tolypodiol
RN: 178948-67-9
InChIKey: NQNQLGPYASRQND-KNFPFGBTSA-N

Note

  • A diterpenoid from the cyanobacterium Tolypothrix nodosa.

Molecular Formula

  • C28-H40-O5

Molecular Weight

  • 456.619
 
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Names and Synonyms

Results Name

  • Tolypodiol

Synonyms

  • 16,24-Cyclo-D(17a)-homo-21-nor-17a-oxachola-16,20(22),23-triene-23-carboxylic acid, 1,6-dihydroxy-4,4,8-trimethyl-, methyl ester, (1beta,5alpha,6beta)-
  • Tolypodiol

Systematic Name

  • 1H-Naphtho(2,1-a)xanthene-10-carboxylic acid, 2,3,4,4a,4b,5,6,6a,12,12a,12b,13,14,14a-tetradecahydro-4,14-dihydroxy-1,1,4a,6a,12b-pentamethyl-, methyl ester, (4R,4aR,4bS,6aS,12aS,12bR,14R,14aS)-

Registry Numbers

CAS Registry Number

  • 178948-67-9

System Generated Number

  • 0178948679

Structure Descriptors

InChI

1S/C28H40O5/c1-25(2)11-10-22(30)28(5)20-9-12-27(4)21(26(20,3)15-18(29)23(25)28)14-17-13-16(24(31)32-6)7-8-19(17)33-27/h7-8,13,18,20-23,29-30H,9-12,14-15H2,1-6H3/t18-,20+,21+,22-,23+,26-,27+,28+/m1/s1

InChIKey

NQNQLGPYASRQND-KNFPFGBTSA-N

Smiles

C1[C@H]2[C@@]3([C@H](CC[C@@]2(Oc2ccc(cc12)C(=O)OC)C)[C@@]1([C@@H](CCC([C@@H]1[C@@H](C3)O)(C)C)O)C)C