Chem
J-GLOBAL ID:200907070432018863
Nikkaji number:J833.364E
11-O-Demethyl-17-O-deacetylvindolin
11-O-デメチル-17-O-デアセチルビンドリン
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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:
C22 H28 N2 O5
Molecular formula furigana:
C22-H28-N2-O5
Molecular weight:
400.475
InChI:
InChI=1S/C22H28N2O5/c1-4-20-8-5-10-24-11-9-21(16(20)24)14-7-6-13(25)12-15(14)23(2)17(21)22(28,18(20)26)19(27)29-3/h5-8,12,16-18,25-26,28H,4,9-11H2,1-3H3/t16-,17+,18+,20+,21+,22-/m0/s1
InChI key:
MNCVVTFLNVITRD-RLFCDOPRSA-N
SMILES:
CC[C@@]12C=CCN3CC[C@@]4([C@H]13)[C@@H](N(C)c1cc(O)ccc41)[C@](O)([C@@H]2O)C(=O)OC
Systematic name (3):
(2β,5α,12R,19α)-1-メチル-6,7-ジデヒドロ-3β,4β,16-トリヒドロキシアスピドスペルミジン-3α-カルボン酸メチル
メチル (1R,9R,10S,11R,12R,19R)-12-エチル-5,10,11-トリヒドロキシ-8-メチル-8,16-ジアザペンタシクロ[10.6.1.01,9 .02,7 .016,19 ]ノナデカ-2,4,6,13-テトラエン-10-カルボキシラート
methyl (1R,9R,10S,11R,12R,19R)-12-ethyl-5,10,11-trihydroxy-8-methyl-8,16-diazapentacyclo[10.6.1.01,9 .02,7 .016,19 ]nonadeca-2,4,6,13-tetraene-10-carboxylate
Other name (4):
11-O-デメチル-17-O-デアセチルビンドリン
11-O-Demethyl-17-O-deacetylvindolin
(2β,5α,12R,19α)-1-Methyl-6,7-didehydro-3β,4β,16-trihydroxyaspidospermidine-3α-carboxylic acid methyl ester
11-O-Demethyl-17-O-deacetylvindoline
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