Chem
J-GLOBAL ID:200907051046560470   Nikkaji number:J499.673I

(2S)-2β-[(Diethoxyphosphinyl)oxy]-5,7-dihydroxy-3β-methoxy-4α-[(2-O-methyl-6-deoxy-α-L-mannopyranosyl)oxy]-3,4-dihydro-2-methylnaphthacene-1,6,11(2H)-trione

(2S)-2β-[(ジエトキシホスフィニル)オキシ]-5,7-ジヒドロキシ-3β-メトキシ-4α-[(2-O-メチル-6-デオキシ-α-L-マンノピラノシル)オキシ]-3,4-ジヒドロ-2-メチルナフタセン-1,6,11(2H)-トリオン
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: C31H37O15P
Molecular formula furigana: C31-H37-O15-P
Molecular weight: 680.596
InChI: InChI=1S/C31H37O15P/c1-7-42-47(39,43-8-2)46-31(4)28(38)16-12-15-19(23(35)18-14(22(15)34)10-9-11-17(18)32)24(36)20(16)26(29(31)41-6)45-30-27(40-5)25(37)21(33)13(3)44-30/h9-13,21,25-27,29-30,32-33,36-37H,7-8H2,1-6H3/t13-,21-,25+,26+,27+,29-,30-,31+/m0/s1
InChI key: ZJSZPCRXLCONMI-WFMYARLESA-N
SMILES: CCOP(=O)(OCC)O[C@@]1(C)[C@@H](OC)[C@H](O[C@@H]2O[C@@H](C)[C@H](O)[C@@H](O)[C@H]2OC)c2c(O)c3C(=O)c4c(O)cccc4C(=O)c3cc2C1=O
Systematic name  (3):
  • (2S)-2β-[(ジエトキシホスフィニル)オキシ]-5,7-ジヒドロキシ-3β-メトキシ-4α-[(2-O-メチル-6-デオキシ-α-L-マンノピラノシル)オキシ]-3,4-ジヒドロ-2-メチルナフタセン-1,6,11(2H)-トリオン
  • (2S,3S,4R)-4-{[(2S,3R,4R,5R,6S)-4,5-ジヒドロキシ-3-メトキシ-6-メチルオキサン-2-イル]オキシ}-5,7-ジヒドロキシ-3-メトキシ-2-メチル-1,6,11-トリオキソ-1,2,3,4,6,11-ヘキサヒドロテトラセン-2-イル ジエチル ホスファート
  • (2S,3S,4R)-4-{[(2S,3R,4R,5R,6S)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxy}-5,7-dihydroxy-3-methoxy-2-methyl-1,6,11-trioxo-1,2,3,4,6,11-hexahydrotetracen-2-yl diethyl phosphate
Other name (1):
  • (2S)-2β-[(Diethoxyphosphinyl)oxy]-5,7-dihydroxy-3β-methoxy-4α-[(2-O-methyl-6-deoxy-α-L-mannopyranosyl)oxy]-3,4-dihydro-2-methylnaphthacene-1,6,11(2H)-trione
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