Colensane and clerodane diterpenoids

Description:

Diterpenoids with a structure based on the clerodane or the colensane skeleton. Clerodanes arise from labdanes by two methyl migrations.

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  1. Rotundifuran
    CAS: 50656-65-0 PubChem CID: 9841926 Formula: C22H34O4 Molecular Weight: 362.5
    Out of Stock Item #: R1290331
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    Technical Identifiers
    IUPAC Name
    [(1R,3R,4R,4aS,8aS)-4-[2-(furan-3-yl)ethyl]-4-hydroxy-3,4a,8,8-tetramethyl-2,3,5,6,7,8a-hexahydro-1H-naphthalen-1-yl] acetate
    SMILES
    CC1CC(C2C(CCCC2(C1(CCC3=COC=C3)O)C)(C)C)OC(=O)C
    InChIKey
    QKHCQFQIJKXMOE-UGFIEOPBSA-N
    InChI
    1S/C22H34O4/c1-15-13-18(26-16(2)23)19-20(3,4)9-6-10-21(19,5)22(15,24)11-7-17-8-12-25-14-17/h8,12,14-15,18-19,24H,6-7,9-11,13H2,1-5H3/t15-,18-,19+,21+,show more
  2. Coronarin A
    CAS: 119188-33-9 PubChem CID: 24851535
    Out of Stock Item #: C1299589
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    Technical Identifiers
    IUPAC Name
    (2S,4R,4aS,8aS)-4-[(E)-2-(furan-3-yl)ethenyl]-4a,8,8-trimethyl-3-methylidene-2,4,5,6,7,8a-hexahydro-1H-naphthalen-2-ol
    SMILES
    CC1(CCCC2(C1CC(C(=C)C2C=CC3=COC=C3)O)C)C
    InChIKey
    RHCBUXSXDFNUAG-UDMCIFMYSA-N
    InChI
    1S/C20H28O2/c1-14-16(7-6-15-8-11-22-13-15)20(4)10-5-9-19(2,3)18(20)12-17(14)21/h6-8,11,13,16-18,21H,1,5,9-10,12H2,2-4H3/b7-6+/t16-,17-,18-,20+/m0/s1
  3. Shionone
    CAS: 10376-48-4 Formula: C30H50O Molecular Weight: 426.72
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: S664612
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    Technical Identifiers
    IUPAC Name
    (1R,4aS,4bS,6aS,8R,10aR,10bS,12aS)-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methylpent-3-enyl)-1,3,4,4a,5,6,7,9,10,10b,11,12-dodecahydrochrysen-2-one
    SMILES
    C[C@H]1C(=O)CC[C@@H]2[C@@]1(CC[C@H]3[C@]2(CC[C@@]4([C@@]3(CC[C@@](C4)(C)CCC=C(C)C)C)C)C)C
    InChIKey
    HXPXUNQUXCHJLL-LZQQOHPBSA-N
    InChI
    1S/C30H50O/c1-21(2)10-9-14-26(4)16-19-30(8)25-13-15-28(6)22(3)23(31)11-12-24(28)29(25,7)18-17-27(30,5)20-26/h10,22,24-25H,9,11-20H2,1-8H3/t22-,24+,25-show more
    Synonyms
    (1R,4aS,4bS,6aS,8R,10aR,10bS,12aS)-Hexadecahydro-1,4b,6a,8,10a,12a-hexamethyl-8-(4-methyl-3-penten-1-yl)-2(1H)-chryse...
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