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Substance Name: Obelmycin D
RN: 107807-17-0
InChIKey: NWSULKNDMBRCNS-UHFFFAOYSA-N

Note

  • A beta-isorhodomycinone glycoside from Streptomyces violaceus.

Molecular Formula

  • C60-H88-N2-O23

Molecular Weight

  • 1205.35
 
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Names and Synonyms

Name of Substance

  • Obelmycin D

Systematic Name

  • Cytorhodin A, 1,3B,3E-trihydroxy-, (3BS,3ES)-

Registry Numbers

CAS Registry Number

  • 107807-17-0

System Generated Number

  • 0107807170

Structure Descriptors

InChI

1S/C60H88N2O23/c1-12-60(73)23-38(80-41-19-30(61(8)9)55(26(4)76-41)83-43-21-36(67)57(28(6)78-43)81-39-17-15-32(63)24(2)74-39)47-50(54(72)49-48(53(47)71)51(69)45-34(65)13-14-35(66)46(45)52(49)70)59(60)85-42-20-31(62(10)11)56(27(5)77-42)84-44-22-37(68)58(29(7)79-44)82-40-18-16-33(64)25(3)75-40/h13-14,24-33,36-44,55-59,63-68,71-73H,12,15-23H2,1-11H3

InChIKey

NWSULKNDMBRCNS-UHFFFAOYSA-N

Smiles

C1[C@@H](O[C@@H]2[C@@H](C[C@@H](O[C@@H]2C)O[C@@H]2[C@@H](C[C@@H](O[C@@H]2C)O[C@@H]2c3c(c4C(c5c(ccc(c5C(c4c(c3[C@@H](C[C@@]2(O)CC)O[C@@H]2C[C@@H]([C@@H]([C@@H](O2)C)O[C@@H]2O[C@@H]([C@@H]([C@@H](C2)O)O[C@@H]2CC[C@@H]([C@@H](O2)C)O)C)N(C)C)O)=O)O)O)=O)O)N(C)C)O)O[C@@H]([C@@H](C1)O)C