Chem
J-GLOBAL ID：201907020915496448   Nikkaji number：J3.739.542K

Hamuramicin A

ハムラミシンA
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C35H50O7
Molecular formula furigana： C35-H50-O7
Molecular weight： 582.778
InChI： InChI=1S/C35H50O7/c1-7-14-29(36)21-19-27(5)34(40)28(6)32-18-12-10-8-9-11-17-30(37)35(41)26(4)16-13-15-24(2)23-31(38)25(3)20-22-33(39)42-32/h7-17,20,23,27-32,34,36-38,40H,18-19,21-22H2,1-6H3/b9-8+,12-10+,14-7-,15-13+,17-11+,24-23+,25-20+,26-16+/t27-,28-,29?,30?,31?,32-,34-/m1/s1
InChI key： USLJRYMOVSWXTE-FYIXLMIJSA-N
SMILES： C1(C(=O)/C(=C/C=C/C(=C/C(/C(=C/CC(=O)O[C@H](C/C=C/C=C/C=C/1)[C@H]([C@@H]([C@@H](CCC(/C=C\C)O)C)O)C)/C)O)/C)/C)O
Systematic name  (2)：
  • (4E,7E,9E,11E,15E,17E,19E,22R)-22-[(2S,3R,4R,8Z)-3,7-ジヒドロキシ-4-メチルデカ-8-エン-2-イル]-6,14-ジヒドロキシ-5,8,12-トリメチル-1-オキサシクロドコサ-4,7,9,11,15,17,19-ヘプタエン-2,13-ジオン
  • (4E,7E,9E,11E,15E,17E,19E,22R)-22-[(2S,3R,4R,8Z)-3,7-dihydroxy-4-methyldec-8-en-2-yl]-6,14-dihydroxy-5,8,12-trimethyl-1-oxacyclodocosa-4,7,9,11,15,17,19-heptaene-2,13-dione
Other name (2)：
  • ハムラミシンA
  • Hamuramicin A
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