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Substance Name: 3'-Hydroxydianemycin
RN: 80118-78-1
InChIKey: GJCZSMNFNGAGGV-BZFNCKAFSA-M

Note

  • From Streptomyces hygroscopicus.

Molecular Weight

  • 905.1
 
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Names and Synonyms

Name of Substance

  • 3'-Hydroxydianemycin

Synonym

  • TM-531C

Systematic Name

  • Dianemycin, 3'-hydroxy-, monosodium salt, (3'R)-

Registry Numbers

CAS Registry Number

  • 80118-78-1

System Generated Number

  • 0080118781

Structure Descriptors

InChI

1S/C47H78O15.Na/c1-12-13-32(39(51)25(2)16-27(4)42(52)53)21-43(9)24-56-45(22-36(43)50)15-14-44(10,62-45)37-20-34(58-38-19-33(49)41(55-11)31(8)57-38)30(7)47(60-37)29(6)18-35(59-47)40-26(3)17-28(5)46(54,23-48)61-40;/h13,25-31,33-38,40-41,48-50,54H,12,14-24H2,1-11H3,(H,52,53);/q;+1/p-1/b32-13+;/t25?,26-,27?,28+,29+,30+,31+,33+,34-,35+,36-,37+,38+,40?,41+,43-,44-,45?,46-,47?;/m0./s1

InChIKey

GJCZSMNFNGAGGV-BZFNCKAFSA-M

Smiles

C([C@@H](C[C@@H](C(\C(=C\CC)C[C@]1(CO[C@@]2(CC[C@@](O2)([C@@H]2O[C@@]3([C@@H](C[C@@H](O3)[C@@H]3[C@H](C[C@H]([C@@](O3)(CO)O)C)C)C)[C@@H]([C@H](C2)O[C@@H]2C[C@H]([C@@H]([C@H](O2)C)OC)O)C)C)C[C@@H]1O)C)=O)C)C)(=O)[O-].[Na+]