Chem
J-GLOBAL ID:200907027708488840
Nikkaji number:J96.680K
Validamycin B
バリダマイシンB
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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:
C20 H35 NO14
Molecular formula furigana:
C20-H35-N-O14
Molecular weight:
513.493
InChI:
InChI=1S/C20H35NO14/c22-2-5-1-7(12(27)15(30)10(5)25)21-9-11(26)6(3-23)19(17(32)14(9)29)35-20-18(33)16(31)13(28)8(4-24)34-20/h1,6-33H,2-4H2/t6-,7-,8+,9-,10+,11+,12-,13+,14-,15-,16-,17+,18+,19+,20-/m0/s1
InChI key:
QYKWCMVFBWGYRE-XROCGEGMSA-N
SMILES:
OC[C@H]1O[C@@H](O[C@H]2[C@H](O)[C@@H](O)[C@@H](N[C@H]3C=C(CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@@H]2CO)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name (4):
(+)-4-O-(β-D-グルコピラノシル)-5-(ヒドロキシメチル)-1-[[(1S)-4β,5α,6β-トリヒドロキシ-3-(ヒドロキシメチル)-2-シクロヘキセン-1β-イル]アミノ]-1,5-ジデオキシ-D-chiro-イノシトール
4-O-β-D-グルコピラノシル-5-(ヒドロキシメチル)-1-[[(1S)-4β,5α,6β-トリヒドロキシ-3-(ヒドロキシメチル)-2-シクロヘキセン-1β-イル]アミノ]-1,5-ジデオキシ-D-chiro-イノシトール
(2R,3S,4S,5R,6R)-2-(ヒドロキシメチル)-6-{[(1R,2R,3S,4S,5R,6S)-2,3,5-トリヒドロキシ-6-(ヒドロキシメチル)-4-{[(1S,4R,5S,6S)-4,5,6-トリヒドロキシ-3-(ヒドロキシメチル)シクロヘキサ-2-エン-1-イル]アミノ}シクロヘキシル]オキシ}オキサン-3,4,5-トリオール
(2R,3S,4S,5R,6R)-2-(hydroxymethyl)-6-{[(1R,2R,3S,4S,5R,6S)-2,3,5-trihydroxy-6-(hydroxymethyl)-4-{[(1S,4R,5S,6S)-4,5,6-trihydroxy-3-(hydroxymethyl)cyclohex-2-en-1-yl]amino}cyclohexyl]oxy}oxane-3,4,5-triol
Other name (13):
Antibiotic T-7545-B
T-7545-B
Validamycin B
バリダマイシンB
Antibiotic T-7545B
抗生物質T-7545B
(+)-Validamycin B
(+)-バリダマイシンB
T-7545B
4-O-β-D-Glucopyranosyl-5-(hydroxymethyl)-1-[[(1S)-4β,5α,6β-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1β-yl]amino]-1,5-dideoxy-D-chiro-inositol
(+)-4-O-(β-D-Glucopyranosyl)-5-(hydroxymethyl)-1-[[(1S)-4β,5α,6β-trihydroxy-3-(hydroxymethyl)-2-cyclohexen-1β-yl]amino]-1,5-dideoxy-D-chiro-inositol
(+)-4-O-(β-D-Glucopyranosyl)-5-(hydroxymethyl)-1-[[(1S)-4β,5α,6β-trihydroxy-3-(hydroxymethyl)-2-cyclohexene-1β-yl]amino]-1,5-dideoxy-D-chiro-inositol
4-O-β-D-Glucopyranosyl-5-(hydroxymethyl)-1-[[(1S)-4β,5α,6β-trihydroxy-3-(hydroxymethyl)-2-cyclohexene-1β-yl]amino]-1,5-dideoxy-D-chiro-inositol
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CAS registry number:
102583-47-1
Regulation number (1):
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