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Substance Name: 16-Hydroxytrichodermadienediol A
RN: 86004-56-0
InChIKey: VOMLNLQETZSQIE-VMXSMMBHSA-N

Note

  • Fermentation product of Myrothecium verrucaria.

Molecular Weight

  • 420.4988
 
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Names and Synonyms

Name of Substance

  • 16-Hydroxytrichodermadienediol A

Systematic Name

  • Trichothec-9-ene-4,16-diol, 12,13-epoxy-, 4-(6,7-dihydroxy-2,4-octadienoate), (4beta(2Z,4E,6S,7S))-

Registry Numbers

CAS Registry Number

  • 86004-56-0

System Generated Number

  • 0086004560

Structure Descriptors

InChI

1S/C23H32O7/c1-14(25)16(26)6-4-5-7-20(27)30-18-11-19-23(13-28-23)22(18,3)21(2)9-8-15(12-24)10-17(21)29-19/h4-7,10,14,16-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t14-,16?,17+,18+,19?,21+,22+,23?/m0/s1

InChIKey

VOMLNLQETZSQIE-VMXSMMBHSA-N

Smiles

C[C@@H](C(/C=C/C=C\C(=O)O[C@@H]1CC2C3([C@]1([C@@]4(CCC(=C[C@H]4O2)CO)C)C)CO3)O)O